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Global Pharma Sourcing, LLC

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Profile: Global Pharma Sourcing, LLC deals with pharmaceutical intermediates. We provide APIs and fine chemical sourcing & custom synthesis services. Our pharmaceutical intermediates include 1,1-bis-methylthio-2-nitroethylene, 1,2-dibromocyclopentene, 2,6-diaminopurine, 2-bromoethyl ether, 2-chloro-1-cyclopentylethanone, cyclopentylacetylene, mucobromic acid, hydroxyethylhydrazine and n-phenylmethoxycarbonyl-3-aminopropanal.

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• R-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4R)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 95530-58-8
Synonyms: 339946_ALDRICH, 59658_FLUKA, (R)-4-Isopropyl-2-oxazolidinone, 4-Isopropyl-1,3-oxazolidin-2-one, ZINC02539403, (R)-()-4-Isopropyl-2-oxazolidinone, 2-oxazolidinone, 4-(1-methylethyl)-, InChI=1/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-YFKPBYRVSA-N

• R-4-Phenyl-2-oxazolidinone
IUPAC Name: (4R)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 90319-52-1
Synonyms: 402451_ALDRICH, ZINC00143125, (R)-(-)-4-Phenyl-2-oxazolidinone, TL8005811, (R)-(−)-4-Phenyl-2-oxazolidinone, A00134

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QDMNNMIOWVJVLY-QMMMGPOBSA-N

• R-Phenylglycinol (R-2-amino-2-phenylethanol)
IUPAC Name: 2-amino-2-phenylethanol | CAS Registry Number: 56613-80-0
Synonyms: beta-Aminophenethyl alcohol, Benzeneethanol, beta-amino-, 2-Amino-2-phenylethanol, ChemDiv2_003373, (R)-(-)-2-Phenylglycinol, Phenethyl alcohol, beta-amino-, d(-)-.alpha.-Phenylglycinol, (R)-beta-Aminophenethyl alcohol, alpha-Phenyl-alpha-amino-beta-oxyethane, Benzeneethanol, .beta.-amino-, (R)-, EINECS 260-287-5, NSC617248, NCI60_005172, LS-103052, 7568-92-5

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IJXJGQCXFSSHNL-UHFFFAOYSA-N

• Repaglinide
IUPAC Name: 2-ethoxy-4-[2-[[(1S)-3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino]-2-oxoethyl]benzoic acid | CAS Registry Number: 135062-02-1
Synonyms: Prandin, NovoNorm, Actulin, GlucoNorm, Repaglinide [USAN], Prandin (TN), Repaglinidum [INN-Latin], Repaglinida [INN-Spanish], Prestwick0_001046, Prestwick1_001046, Prestwick2_001046, Prestwick3_001046, AG-EE 388 ZW, AG-EE 623 ZW, BSPBio_000972, MLS000759407, MLS001076684, R9028_SIGMA, Repaglinide (JAN/USP/INN), SPBio_002906

Molecular Formula: C27H36N2O4Molecular Weight: 452.585740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FAEKWTJYAYMJKF-QHCPKHFHSA-N

• Rhodanine
IUPAC Name: 2-sulfanylidene-1,3-thiazolidin-4-one | CAS Registry Number: 141-84-4
Synonyms: RHODANINE, Rhodaninic acid, Rhodanic acid, Rodanin, Rhodanin, Rhodanin [Czech], 2-Thioxo-4-thiazolidinone, 4-Thiazolidinone, 2-thioxo-, Aminorhodanine deriv, 4-Oxo-2-thioxothiazoline, 2-Thio-4-ketothiazolidine, 4-Thiazolidinone-2-thione, USAF HA-2, 2-Mercaptothiazolinone, 4-Oxo-2-thionothiazolidine, 4-Thioxo-4-thiazolidone, 4-Oxo-2-thiothiazolidin, 2-Thioxo-1,3-thiazolidin-4-one, 2,4-Thiazolidinedione, 2-thio-, CCRIS 4867

Molecular Formula: C3H3NOS2Molecular Weight: 133.192020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KIWUVOGUEXMXSV-UHFFFAOYSA-N

• S-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4S)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 17016-83-0
Synonyms: 298883_ALDRICH, 59660_FLUKA, ZINC04262265, (4S)-(-)-4-Isopropyl-2-oxazolidinone, TL8001333, (S)-(−)-4-Isopropyl-2-oxazolidinone

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-RXMQYKEDSA-N

• S-4-Phenyl-2-oxazolidinone
IUPAC Name: (4S)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 99395-88-7
Synonyms: 376698_ALDRICH, 78875_FLUKA, (S)-()-4-Phenyl-2-oxazolidinone, ZINC00143123, (S)-(+)-4-Phenyl-2-oxazolidinone, TL8006065, A00133, InChI=1/C9H9NO2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QDMNNMIOWVJVLY-MRVPVSSYSA-N

• Squaric Acid
IUPAC Name: 3,4-dihydroxycyclobut-3-ene-1,2-dione | CAS Registry Number: 2892-51-5
Synonyms: Squaric acid, Quadratic acid, Cyclobutenedione, dihydroxy-, Dihydroxycyclobutenedione, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, CCRIS 6793, WLN: L4VVTJ CQ DQ, 3-Cyclobutene-1,2-dione, 3,4-dihydroxy-, 1,2-Dihydroxycyclobutene-3,4-dione, 1,2-Diketo-3,4-dihydroxycyclobutene, 123447_ALDRICH, 3,4-Dihydroxy-cyclobutene-1,2-dione, EINECS 220-761-4, NSC624671, AIDS160322, NSC 125692, AIDS-160322, BRN 0774275, Cyclobutenedione, dihydroxy- (8CI), NSC125692

Molecular Formula: C4H2O4Molecular Weight: 114.056280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PWEBUXCTKOWPCW-UHFFFAOYSA-N

• Stannous Methane Sulphonate
IUPAC Name: methanesulfonate; tin(2+) | CAS Registry Number: 53408-94-9
Synonyms: 462675_ALDRICH, Methanesulfonic acid, tin(2+) salt, Tin(II) methanesulfonate solution, CID6452824, 765922-96-1

Molecular Formula: C2H6O6S2SnMolecular Weight: 308.905440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: JALQQBGHJJURDQ-UHFFFAOYSA-L

• Stavudine
IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 3056-17-5
Synonyms: stavudine, sanilvudine, Zerit, ddeThd, ddeTyd, Zent, Zerut XR, D 4T (nucleoside), Stavudinum [INN-Latin], Sanilvudine (JAN), Dideoxydidehydrothymidine, Estavudina [INN-Spanish], Zerit (TN), 2',3'-Didehydro-3'-deoxythymidine, Stavudine (USAN/INN), 2',3'-Anhydrothymidine, Stavudine [USAN:BAN:INN], 3'-Deoxy-2'-thymidinene, 2'-Thymidinene, 3'-deoxy-, D 4T

Molecular Formula: C10H12N2O4Molecular Weight: 224.213280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XNKLLVCARDGLGL-JGVFFNPUSA-N

• Terbinafine HCl
IUPAC Name: (E)-N,6,6-trimethyl-N-(naphthalen-1-ylmethyl)hept-2-en-4-yn-1-amine hydrochloride | CAS Registry Number: 78628-80-5
Synonyms: Lamisil, Lamisil Krem, Terbisil, Afogan, Daskil, Lamisil AT, TerbiFoam, InnoNyx, Terbinafine hydrochloride, Terbinafinum [Latin], Terbinafina [Spanish], Lamisil (TN), Ambap2235, SF 86-327 hydrochloride, C21H25N.HCl, MLS001066620, MLS001304037, MLS001401424, DRG-0286, Terbinafine hydrochloride (JAN)

Molecular Formula: C21H26ClNMolecular Weight: 327.890840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BWMISRWJRUSYEX-SZKNIZGXSA-N

• tert-Butyl carbamate
IUPAC Name: tert-butyl carbamate | CAS Registry Number: 4248-19-5
Synonyms: Boc-amide, T-butyl carbamate, 167398_ALDRICH, 21759_FLUKA, Carbamic acid, 1,1-dimethylethyl ester, CID77922, EINECS 224-209-3, NSC131089, ZINC00388418, TL8003021, BOC

Molecular Formula: C5H11NO2Molecular Weight: 117.146340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LFKDJXLFVYVEFG-UHFFFAOYSA-N

• tert-Butyl N-(4-bromophenyl)carbamate
IUPAC Name: tert-butyl N-(4-bromophenyl)carbamate | CAS Registry Number: 131818-17-2
Synonyms: tert-butyl 4-bromophenylcarbamate, tert-Butyl (4-bromophenyl)carbamate, tert-butyl N-(4-bromophenyl)carbamate, N-(tert-Butoxycarbonyl)-4-bromoaniline, n-boc-4-bromoaniline, ST51041766, ZINC00403447, N-BOC 4-bromoaniline, SureCN467281, AC1MCN75, ACMC-1C4Z5, 527246_ALDRICH, CTK8B0139, 4-Bromoaniline, N-BOC protected, MolPort-000-152-542, ANW-19387, AKOS003477424, tert-butyl-n-(4-bromophenyl)carbamate, QC-7798, RP06509

Molecular Formula: C11H14BrNO2Molecular Weight: 272.138360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VLGPDTPSKUUHKR-UHFFFAOYSA-N

• Ticarcillin Disodium
IUPAC Name: disodium (2S,5R,6R)-3,3-dimethyl-6-[[(2R)-3-oxido-3-oxo-2-thiophen-3-ylpropanoyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS Registry Number: 4697-14-7
Synonyms: Aerugipen, Ticar, ticarcillin sodium, TICARCILLIN, Ticar (TN), TICARCILLIN DISODIUM, Ticarcillin disodium salt, Ticarcillin sodium (JAN), Ticarcillin disodium (USP), T5639_SIGMA, CHEBI:35017, AIDS070037, AIDS-070037, NCGC00017046-01, CAS-4697-14-7, C14021, D02241, (2S,5R,6R)-6-[[(2R)-CARBOXY-3-THIENYLACETYL]AMINO]-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID DISODIUM SALT, 34787-01-4, disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-thiophen-3-ylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Molecular Formula: C15H14N2Na2O6S2Molecular Weight: 428.391000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: ZBBCUBMBMZNEME-QBGWIPKPSA-L

• Torsemide
IUPAC Name: 1-[4-(3-methylanilino)pyridin-3-yl]sulfonyl-3-propan-2-ylurea | CAS Registry Number: 56211-40-6
Synonyms: Torasemide, Demadex, TORSEMIDE, Luprac, Presoril, Toradiur, Torocard, Dilutol, Sutril, Torrem, Torem, Unat, Torasemide N, Torsemide [USAN], Torsemide (USP), Demadex (TN), Luprac (TN), Torasemidum [INN-Latin], Torasemida [INN-Spanish], Ambap3994

Molecular Formula: C16H20N4O3SMolecular Weight: 348.420000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: NGBFQHCMQULJNZ-UHFFFAOYSA-N

• Tosylmethyl isocyanide
IUPAC Name: 1-(isocyanomethylsulfonyl)-4-methylbenzene | CAS Registry Number: 36635-61-7
Synonyms: TosMIC, 188204_ALDRICH, 89816_FLUKA, p-Toluenesulfonylmethyl isocyanide, 4-Toluenesulfonylmethyl isocyanide, NSC631633, (p-Tolylsulfonyl)methyl isocyanide, AIDS134172, AIDS-134172, EINECS 253-140-1, (p-Toluenesulphonyl)methyl isocyanide, ST5406653, Benzene, 1-((isocyanomethyl)sulfonyl)-4-methyl-, (Methylidyne-.lambda.~5~-azanyl)methyl 4-methylphenyl sulfone, Methylidyne(((4-methylphenyl)sulfonyl)methyl)-.lambda.~5~-azane

Molecular Formula: C9H9NO2SMolecular Weight: 195.238260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CFOAUYCPAUGDFF-UHFFFAOYSA-N

• trans,trans-2,4-Hexadien-1-ol
IUPAC Name: (2E,4E)-hexa-2,4-dien-1-ol | CAS Registry Number: 17102-64-6
Synonyms: Sorbic alcohol, Hexacose, Hexadenol, Hexakose, Hexenol, Sorbyl alcohol, Sorbinic alcohol, Hexene-ol, 2,4-Hexadienol, 2,4-HEXADIEN-1-OL, 1-Hydroxy-2,4-hexadiene, n-Hexa-2,4-dien-1-ol, (E,E)-2,4-Hexadien-1-ol, W392200_ALDRICH, 183059_ALDRICH, EINECS 203-853-9, (E,E)-Hexa-2,4-dien-1-ol, 2,4-Hexadien-1-ol, (2E,4E)-, 2,4-Hexadien-1-ol, (E,E)-, EINECS 241-173-4

Molecular Formula: C6H10OMolecular Weight: 98.143000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MEIRRNXMZYDVDW-MQQKCMAXSA-N

• Trilostane
Synonyms: Modrenal, Desopan, Modrenal (TN), Desopan (TN), Trilostane (JAN/USAN), CHEBI:32260, DB01108, D01180, 3,17beta-dihydroxy-4alpha,5-epoxy-5alpha-androst-2-ene-2-carbonitrile, (4alpha,5alpha,17beta)-3,17-dihydroxy-4,5-epoxyandrost-2-ene-2-carbonitrile

Molecular Formula: C20H27NO3Molecular Weight: 329.433280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KVJXBPDAXMEYOA-CXANFOAXSA-N

• Uracil
IUPAC Name: 1H-pyrimidine-2,4-dione | CAS Registry Number: 66-22-8
Synonyms: uracil, 2,4-Dihydroxypyrimidine, 2,4(1H,3H)-Pyrimidinedione, 2,4-Pyrimidinediol, pyrimidine-2,4(1H,3H)-dione, 2,4-Dioxopyrimidine, 2,4-Pyrimidinedione, Pirod, Pyrod, pyrimidine-2,4-diol, Hybar X, 1H-Pyrimidine-2,4-dione, 51953-14-1, RU 12709, Ura, Uracil [USAN], 1,2,3,4-tetrahydropyrimidine-2,4-dione, CCRIS 3077, Urazil, 2-Hydroxy-4(3H)-pyrimidinone

Molecular Formula: C4H4N2O2Molecular Weight: 112.090 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ISAKRJDGNUQOIC-UHFFFAOYSA-N

• Ursodeoxycholic Acid
IUPAC Name: (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid | CAS Registry Number: 128-13-2
Synonyms: ursodiol, Actigall, Delursan, Destolit, Litursol, Peptarom, Solutrat, Ursobilin, Ursochol, Ursodamor, Ursofalk, Ursolvan, Arsacol, Deursil, Ursacol, Lyeton, Cholit-ursan, URSODEOXYCHOLIC ACID, UrSO, Urso Forte

Molecular Formula: C24H40O4Molecular Weight: 392.572000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: RUDATBOHQWOJDD-UZVSRGJWSA-N

• Vinylene Carbonate
IUPAC Name: 1,3-dioxol-2-one | CAS Registry Number: 872-36-6
Synonyms: Vinyl carbonate, VINYLENE CARBONATE, 1,3-Dioxol-2-one, WLN: T5OVOJ, V2607_ALDRICH, Carbonic acid, cyclic vinylene ester, 1,3-Dioxol-2-one (9CI), EINECS 212-825-5, NSC 20980, NSC 47201, NSC20980, NSC47201, BRN 0105683, ZINC01577290, LS-51954, 5-19-04-00072 (Beilstein Handbook Reference)

Molecular Formula: C3H2O3Molecular Weight: 86.046180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VAYTZRYEBVHVLE-UHFFFAOYSA-N

• Zofenoprilate
IUPAC Name: (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-phenylsulfanylpyrrolidine-2-carboxylic acid | CAS Registry Number: 75176-37-3
Synonyms: Zofenoprilat, 2ewb, Zofenoprilate [INN-French], Zofenoprilatum [INN-Latin], ZED, L-Proline, 1-(3-mercapto-2-methyl-1-oxopropyl)-4-(phenylthio)-, (1(R*),2alpha,4alpha)-, L-PROLINE, 1-[(2S)-3-MERCAPTO-2-METHYL-1-OXOPROPYL]-4-(PHENYLTHIO)-, 4S

Molecular Formula: C15H19NO3S2Molecular Weight: 325.446260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UQWLOWFDKAFKAP-WXHSDQCUSA-N

• (S)-(+)-2-Amino-2-Phenylethanol
IUPAC Name: (2S)-2-amino-2-phenylethanol | CAS Registry Number: 20989-17-7
Synonyms: D-Phenylglycinol, 2-Amino-2-phenylethanol, 2-Amino-2-pheynlethanol, 2-Amino-2-phenyl-ethanol, L-()-alpha-Phenylglycinol, Benzeneethanol, beta-amino-, (S)-()-2-Phenylglycinol, (S)-2-Amino-2-phenylethanol, 282693_ALDRICH, 78585_FLUKA, Benzeneethanol, beta-amino-, (S)-, SBB006667, TL806424, InChI=1/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IJXJGQCXFSSHNL-MRVPVSSYSA-N

• 2-Amino-5-bromopyrimidine
IUPAC Name: 5-bromopyrimidin-2-amine | CAS Registry Number: 7752-82-1
Synonyms: 5-Bromo-2-pyrimidinamine, 2-Pyrimidinamine, 5-bromo-, 5-bromopyrimidin-2-ylamine, Pyrimidine, 2-amino-5-bromo-, 303526_ALDRICH, NSC27269, SBB000184, ZINC00967319, TL806169, AC-907/25014021, SR-01000639998-1

Molecular Formula: C4H4BrN3Molecular Weight: 173.998660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UHRHPPKWXSNZLR-UHFFFAOYSA-N

• 2,4,5-Trifluorobenzoic Acid
IUPAC Name: 2,4,5-trifluorobenzoate | CAS Registry Number: 446-17-3
Synonyms: ZINC00164626, CID6933310

Molecular Formula: C7H2F3O2-Molecular Weight: 175.084790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: AKAMNXFLKYKFOJ-UHFFFAOYSA-M

• 6-Chloro-o-Toluidine (6COT)
IUPAC Name: 2-chloro-6-methylaniline | CAS Registry Number: 87-63-8
Synonyms: 6-Chloro-o-toluidine, o-Toluidine, 6-chloro-, 2-Chloro-6-methylaniline, 2-Amino-3-chlorotoluene, 6-Chloro-2-toluidine, 3-Chloro-2-aminotoluene, 2-Methyl-6-chloroaniline, Benzenamine, 2-chloro-6-methyl-, 6-CHLORO-2-METHYLANILINE, WLN: ZR BG F1, C51008_ALDRICH, 6-Chloro-o-toluidine (NH2=1), NSC60121, EINECS 201-759-2, CID6897, 6-Chloro-o-toluidine [NH2=1], Benzenamine, 6-chloro-2-methyl-, NSC 60121, BRN 0774624, SBB004153

Molecular Formula: C7H8ClNMolecular Weight: 141.598120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WFNLHDJJZSJARK-UHFFFAOYSA-N

• 2,4,6-Trifluorobenzoic acid
IUPAC Name: 2,4,6-trifluorobenzoic acid | CAS Registry Number: 28314-80-9
Synonyms: 345784_ALDRICH, JRD-0084, CID520373, SBB006688, TL806137, InChI=1/C7H3F3O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12

Molecular Formula: C7H3F3O2Molecular Weight: 176.092730 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SJZATRRXUILGHH-UHFFFAOYSA-N

• 2,2'-Dithiobis(3-methyl)benzoic acid
IUPAC Name: 2-[(2-carboxy-6-methylphenyl)disulfanyl]-3-methylbenzoic acid | CAS Registry Number: 13363-59-2
Synonyms: 2,2'-Dithiobis(3-methylbenzoic acid), AG-D-68593, Benzoic acid,2,2'-dithiobis[3-methyl-, CTK4B8709, SBB068002, 2,2'-DITHIODI-M-TOLUIC ACID, AKOS015842496, AC-18186, m-Toluicacid, 2,2'-dithiodi- (8CI);, KB-163905, Benzoic acid,2,2'-dithiobis[3-methyl- (9CI), BENZOIC ACID,2,2'-DITHIOBIS[3-METHYL]-, A806657, I14-5417, 2-[(2-carboxy-6-methylphenyl)disulfanyl]-3-methylbenzoic acid, 2-[(2-carboxy-6-methyl-phenyl)disulfanyl]-3-methyl-benzoic acid

Molecular Formula: C16H14O4S2Molecular Weight: 334.409960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: NRIKVCMXILLQNH-UHFFFAOYSA-N

• 4-Diaminobenzene (4-Phenylenediamine)
IUPAC Name: benzene-1,4-diamine | CAS Registry Number: 106-50-3
Synonyms: p-Phenylenediamine, p-Aminoaniline, 4-Aminoaniline, p-Diaminobenzene, Orsin, p-Phenyldiamine, p-Benzenediamine, Fouramine D, Futramine D, Benzofur D, Developer PF, Fourrine D, Fur Yellow, Santoflex IC, Santoflex LC, 1,4-Phenylenediamine, Pelagol D, Tertral D, Durafur Black R, Pelagol DR

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CBCKQZAAMUWICA-UHFFFAOYSA-N

• 2-Chloro-3-fluoroaniline
IUPAC Name: 2-chloro-3-fluoroaniline | CAS Registry Number: 21397-08-0
Synonyms: 2-Chloro-3-fluoro-aniline, EINECS 244-366-1, CID88884, TL8001775

Molecular Formula: C6H5ClFNMolecular Weight: 145.562003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FJKIADFDXOCBRV-UHFFFAOYSA-N

• 2,6-Difluorobenzamide
IUPAC Name: 2,6-difluorobenzamide | CAS Registry Number: 18063-03-1
Synonyms: Benzamide, 2,6-difluoro-, Ambap1714, 282278_ALDRICH, EINECS 241-972-8, ZINC00152949, CID87439, JRD-0429, LS-26492, TL8001442, InChI=1/C7H5F2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11

Molecular Formula: C7H5F2NOMolecular Weight: 157.117506 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AVRQBXVUUXHRMY-UHFFFAOYSA-N

• 6-Methoxy Quinoline
IUPAC Name: 6-methoxyquinoline | CAS Registry Number: 5263-87-6
Synonyms: 6-Methoxyquinoline, Quinoline, 6-methoxy-, METHOXYQUINOLINE, Methyl 6-quinolyl ether, WLN: T66 BNJ HO1, 183067_ALDRICH, 64950_FLUKA, NSC1954, AIDS020560, AIDS-020560, NSC 1954, EINECS 226-077-2, SBB008352, AI3-16316, InChI=1/C10H9NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h2-7H,1H, 1321-72-8

Molecular Formula: C10H9NOMolecular Weight: 159.184560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HFDLDPJYCIEXJP-UHFFFAOYSA-N

• 2-Aminoanisole
IUPAC Name: 2-methoxyaniline | CAS Registry Number: 90-04-0
Synonyms: 2-Methoxyaniline, O-ANISIDINE, o-Aminoanisole, o-Methoxyaniline, 2-Anisidine, o-Anisylamine, Benzenamine, 2-methoxy-, Anisidine, o-Methoxyphenylamine, Ortho-anisidine, ortho-Aminoanisole, ortho-Methoxyaniline, 2-Methoxybenzenamine, ortho-Methoxyphenylamine, 1-Amino-2-methoxybenzene, 2-Methoxy-1-aminobenzene, ANISIDINE ISOMERS, Benzenamine, ar-methoxy-, 2-METHOXY-ANILINE, CCRIS 768

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VMPITZXILSNTON-UHFFFAOYSA-N

• 4-Hydroxybenzoic Acid
IUPAC Name: 4-hydroxybenzoic acid | CAS Registry Number: 99-96-7
Synonyms: p-Hydroxybenzoic acid, 4-Carboxyphenol, p-Salicylic acid, 4-HYDROXYBENZOIC ACID, p-hydroxybenzoate, Paraben, 4-hydroxybenzoate, Benzoic acid, 4-hydroxy-, Benzoic acid, p-hydroxy-, 3pcc, 3pch, 4-Hydroxybenzoesaeure, Hydroxybenzoic acid, phenol derivative, 8, p-Oxybenzoesaure [German], Benzoic acid, p-hydroxy, Benzoic acid, 4-hydroxy, WLN: QVR DQ, CID135, Hydroxybenzenecarboxylic acid

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FJKROLUGYXJWQN-UHFFFAOYSA-N

• (S)-4-Benzyl-3-propionyl-2-oxazolidinone
IUPAC Name: (4S)-4-(phenylmethyl)-3-propanoyl-1,3-oxazolidin-2-one | CAS Registry Number: 101711-78-8
Synonyms: 458775_ALDRICH, ZINC00403113, CID2733696, ST5405910, TL8000098, (S)-()-4-Benzyl-3-propionyl-2-oxazolidinone, (4S)-(+)-4-Benzyl-3-propionyl-2-oxazolidinone

Molecular Formula: C13H15NO3Molecular Weight: 233.263100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WHOBYFHKONUTMW-NSHDSACASA-N

• 2-Bromo-3,4,5,6-tetramethoxytoluene
IUPAC Name: 1-bromo-2,3,4,5-tetramethoxy-6-methylbenzene | CAS Registry Number: 73875-27-1
Synonyms: 2-Methyl-3,4,5,6-tetramethoxybromobenzene, 1-Bromo-2,3,4,5-tetramethoxy-6-methylbenzene, 2-bromo-3,4,5,6-tetramethoxytoluene, AG-G-92861, PubChem13663, CTK5D8847, MolPort-001-758-026, ZINC15021199, AKOS015890011, AC-4354, AG-G-87368, AK-36254, P424, KB-173641, TL8005110, FT-0641492, FT-0658053, ST51051843, A837948, Benzene,1-bromo-2,3,4,5-tetramethoxy-6-methyl-

Molecular Formula: C11H15BrO4Molecular Weight: 291.138400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FQPOTLCIUAYGPN-UHFFFAOYSA-N

• 2,6-Xylidine
IUPAC Name: 2,6-dimethylaniline | CAS Registry Number: 87-62-7
Synonyms: 2,6-Dimethylaniline, o-Xylidine, 2,6-XYLIDINE, 2-Amino-m-xylene, Xylylamine, 2,6-Xylylamine, o-Xylidine (VAN), Benzenamine, 2,6-dimethyl-, 2-Amino-1,3-xylene, 2,6-Dimethylbenzenamine, Aniline, 2,6-dimethyl-, 2,6-Dimethylphenylamine, 2-Amino-1,3-dimethylbenzene, 1-Amino-2,6-dimethylbenzene, 2,6-xylidine hydrochloride, CCRIS 2373, 2,6-xylidine, 3H-labeled, NCI-C56188, HSDB 2094, D146005_ALDRICH

Molecular Formula: C8H11NMolecular Weight: 121.179640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UFFBMTHBGFGIHF-UHFFFAOYSA-N

• 5-Thia-1-Azabicyclo[4.2.0]oct-2-Ene-2-Carboxylic Acid, 7-Amino-3-Ethenyl-8-Oxo-, (6R,7R)-
IUPAC Name: (6R,7R)-7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 79349-82-9
Synonyms: AG-H-18359, 7-Amino-3-vinyl-3-cephem-4-carboxylic acid, (6R,7R)-7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-Amino-8-oxo-3-vinyl-5-thia-1-azabicylo[4.2.0]oct-2-ene-2-carboxylic acid, AC1OIKWK, 7-AVCA, SureCN5284761, CTK2H7065, MolPort-005-938-002, SBB065760, AKOS015892740, AC-5550, K402, FT-0641715, A839658, (6R,7R)-7-Amino-8-oxo-3-vinyl-5-thia-1-azabicylo[4.2.0]oct-2-e ne-2-carboxylic acid, (6R-trans)-7-Amino-3-ethenyl-8-oxo-5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, (6R,7R)-7-AMINO-3-VINYL-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID, (6R,7R)-7-azanyl-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid, 7-amino-3-ethenyl-8-oxo-, (6R,7R)-

Molecular Formula: C9H10N2O3SMolecular Weight: 226.252300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GQLGFBRMCCVQLU-SVGQVSJJSA-N

• 4-Aminoanisole
IUPAC Name: 4-methoxyaniline | CAS Registry Number: 104-94-9
Synonyms: p-Anisidine, 4-Methoxyaniline, p-Aminoanisole, p-Anisylamine, p-Methoxyaniline, 4-Anisidine, p-Dianisidine, p-Methoxyphenylamine, Benzenamine, 4-methoxy-, Anisole, p-amino-, 4-Methoxybenzenamine, 4-Methoxybenzeneamine, Aniline, p-methoxy-, Aniline, 4-methoxy-, 1-Amino-4-methoxybenzene, 4-Methoxy-1-aminobenzene, 4-METHYOXYANILINE, 4-METHOXY-ANILINE, CCRIS 917, WLN: ZR DO1

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BHAAPTBBJKJZER-UHFFFAOYSA-N

• 5-(2-Chloro-6-Fluorophenyl)-2H-Tetrazole
IUPAC Name: 5-(2-chloro-6-fluorophenyl)-2H-tetrazole | CAS Registry Number: 503293-47-8
Synonyms: 5-(2-chloro-6-fluorophenyl)-2H-tetrazole, Enamine_005342, AC1M66MU, SureCN3305051, CTK7C2193, HMS1409C18, SBB092375, AKOS000116492, AKOS008966879, AG-C-76453, FT-0692609, A828068, 5-(2-CHLORO-6-FLUORO-PHENYL)-2H-TETRAZOLE, T5832108, 5-(2-chloro-6-fluorophenyl)-2H-1,2,3,4-tetrazole, 5-(6-chloro-2-fluorophenyl)-2H-1,2,3,4-tetraazole, T0516-7146, 5-(2-chloranyl-6-fluoranyl-phenyl)-2H-1,2,3,4-tetrazole

Molecular Formula: C7H4ClFN4Molecular Weight: 198.584863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UBJCVTCTBVLUIS-UHFFFAOYSA-N

• 2,4,5,6-Tetraaminopyrimidine Sulfate
IUPAC Name: pyrimidine-2,4,5,6-tetramine; sulfuric acid | CAS Registry Number: 5392-28-9
Synonyms: Pyrimidinetetramine sulphate, Pyrimidinetetramine, sulfate, T3807_ALDRICH, 2,4,5,6-Tetraaminopyrimidine sulfate, Pyrimidinetetramine, sulfate (1:1), NSC3277, Pyrimidinetetrayltetraamine sulphate, NSC 3277, EINECS 226-393-0, EINECS 256-407-0, Pyrimidine, tetraamino-, sulfate (1:1), TL806380, 2,4,5,6-Tetraaminopyrimidine sulfate salt, AI3-17130, LS-135528, Pyrimidine, 2,4,5,6-tetraamino-, sulfate, 49647-58-7

Molecular Formula: C4H10N6O4SMolecular Weight: 238.225000 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: MQEFDQWUCTUJCP-UHFFFAOYSA-N

• 2,6-Diaminopurine
IUPAC Name: 7H-purine-2,6-diamine | CAS Registry Number: 1904-98-9
Synonyms: 2-Aminoadenine, Diaminopurine, 1H-Purine-2,6-diamine, 2-6-Diaminopurine, Purine, 2,6-diamino-, Purine-2,6-diyldiamine, 9H-Purine-2,6-diamine, 7H-purine-2,6-diamine, CCRIS 923, Purine, 2, 6-diamino-, Oprea1_670021, MLS001066366, NSC 743, 247847_ALDRICH, C5H6N6, NSC743, EINECS 217-605-2, AIDS023709, SQ 21065, X 79

Molecular Formula: C5H6N6Molecular Weight: 150.141340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: MSSXOMSJDRHRMC-UHFFFAOYSA-N

• 2-Methyl-5-nitroanisole
IUPAC Name: 2-methoxy-1-methyl-4-nitrobenzene | CAS Registry Number: 13120-77-9
Synonyms: 2-Methoxy-4-nitrotoluene, 5-nitro-2-methylanisole, Anisole, 2-methyl-5-nitro-, Methyl 5-nitro-o-tolyl ether, 213187_ALDRICH, NSC25213, Benzene, 2-methoxy-1-methyl-4-nitro-, EINECS 236-048-6, NSC 25213, ZINC01621823, FR-2368, TL8000739, N00004, InChI=1/C8H9NO3/c1-6-3-4-7(9(10)11)5-8(6)12-2/h3-5H,1-2H

Molecular Formula: C8H9NO3Molecular Weight: 167.161960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WVQGZNRUEVFXKR-UHFFFAOYSA-N

• 2-Amino-3,5-dimethylbenzoic acid
IUPAC Name: 2-amino-3,5-dimethylbenzoic acid | CAS Registry Number: 14438-32-5
Synonyms: 3,5-Dimethylanthranilic acid, MLS000736898, D146803_ALDRICH, NSC90444, SMR000528415, ST5407953, InChI=1/C9H11NO2/c1-5-3-6(2)8(10)7(4-5)9(11)12/h3-4H,10H2,1-2H3,(H,11,12

Molecular Formula: C9H11NO2Molecular Weight: 165.189140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GIMYRAQQQBFFFJ-UHFFFAOYSA-N

• 2,6-Difluoroaniline
IUPAC Name: 2,6-difluoroaniline | CAS Registry Number: 5509-65-9
Synonyms: Benzenamine, 2,6-difluoro-, 196614_ALDRICH, BB_SC-4594, EINECS 226-853-0, NSC127234, ZINC00159273, D155, TL8003601, InChI=1/C6H5F2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ODUZJBKKYBQIBX-UHFFFAOYSA-N

• 1,2,4,5-Tetrafluorobenzene
IUPAC Name: 1,2,4,5-tetrafluorobenzene | CAS Registry Number: 327-54-8
Synonyms: 1,2,4,5-TETRAFLUOROBENZENE, Benzene, 1,2,4,5-tetrafluoro-, T11657_ALDRICH, 2,3,5,6-Tetrafluorobenzene, NSC10249, EINECS 206-319-3, T101, TL8002468

Molecular Formula: C6H2F4Molecular Weight: 150.073693 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SDXUIOOHCIQXRP-UHFFFAOYSA-N

• 2-Amino-3-Methyl Benzoic Acid
IUPAC Name: 2-amino-3-methylbenzoic acid | CAS Registry Number: 4389-45-1
Synonyms: 2-Amino-3-methylbenzoic acid, 3-Methylanthranilic acid, 3-methylanthranilate, 3-Methylanthranil acid, 2-Amino-3-methylbenzate, 3 -methylanthranilic acid, 3-Methyl-2-aminobenzoic acid, m-Toluic acid, 2-amino-, Benzoic acid, 2-amino-3-methyl-, A62205_ALDRICH, 2-AMINO-M-TOLUIC ACID, 08401_FLUKA, m-Toluic acid, 2-amino- (8CI), NSC16049, EINECS 224-505-2, CPD0-1490, NSC 16049, Benzoic acid, 2-amino-3-methyl- (9CI), ST5437295, TL8003074

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNAJXPYVTFYEST-UHFFFAOYSA-N

• 2,3,4-Trifluorobenzonitrile
IUPAC Name: 2,3,4-trifluorobenzonitrile | CAS Registry Number: 143879-80-5
Synonyms: Ambap1782, JRD-0343, ZINC00389524

Molecular Formula: C7H2F3NMolecular Weight: 157.092690 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: KTPHYLJFAZNALV-UHFFFAOYSA-N

• 3-Trifluoromethyl Benzoic Acid
IUPAC Name: 3-(trifluoromethyl)benzoic acid | CAS Registry Number: 454-92-2
Synonyms: 3-(Trifluoromethyl)benzoic acid, 3-Carboxybenzotrifluoride, 3-Trifluoromethylbenzoate, m-CARBOXYBENZOTRIFLUORIDE, 188344_ALDRICH, m-(Trifluoromethyl)benzoic acid, 91770_FLUKA, AIDS018130, alpha,alpha,alpha-Trifluoro-m-toluic acid, AIDS-018130, JRD-0051, NSC43025, 3-TRIFLUOROMETHYLBENZOIC ACID, Benzoic acid, 3-(trifluoromethyl)-, EINECS 207-230-2, NSC 43025, SBB003661, alpha,alpha,alpha-Tri-fluoro-m-toluic acid, Benzoic acid, 3-(trifluoromethyl)- (9CI), TL8003158

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: FQXQBFUUVCDIRK-UHFFFAOYSA-N

• 1-Fluoronaphthalene
IUPAC Name: 1-fluoronaphthalene | CAS Registry Number: 321-38-0
Synonyms: Naphthalene, 1-fluoro-, 1-FLUORONAPHTHALENE, Fluoronaphthalene, alpha-Fluoronaphthalene, .alpha.-Fluoronaphthalene, 1-Fluornaftalen [Czech], WLN: L66J BF, 196657_ALDRICH, 442266_SUPELCO, NSC 4690, EINECS 206-287-0, NSC4690, JRD-1263, BRN 1906413, LS-94702, TL8002443, 4-05-00-01657 (Beilstein Handbook Reference), InChI=1/C10H7F/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7

Molecular Formula: C10H7FMolecular Weight: 146.160983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CWLKTJOTWITYSI-UHFFFAOYSA-N


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