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Profile: Spectrum Info Ltd. focuses on laboratory scale synthesis of fine organic chemicals and combinatorial building blocks. We provide rare and commercially unavailable compounds for research chemists. Our catalog of fine chemicals contains several hundred building blocks for organic synthesis. We provide about 500 synthetic dyes of various classes covering the absorbance range 350-1100 nm. Specialty dyes catalog includes laser dyes, fluorescent probes, dyes for worm disks production & electrophotography, silver halide sensitizers for visible & near IR region, and indicators.

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• 4-Phenoxybenzenesulfonyl chloride
IUPAC Name: 4-(phenoxy)benzenesulfonyl chloride | CAS Registry Number: 1623-92-3
Synonyms: 4-Phenoxy-benzenesulfonyl chloride, 4PBS-0-0, ALD-N000880, GL-1068

Molecular Formula: C12H9ClO3SMolecular Weight: 268.716060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QIZPONOMFWAPRR-UHFFFAOYSA-N

• 4-Chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
IUPAC Name: 1-chloro-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-d]pyrimidine | CAS Registry Number: 300816-22-2
Synonyms: 4-chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine, 4-Chloro-2,3-dihydro-1H-8-thia-5,7-diaza-cyclopenta[a]indene, 4-chloro-5,6,7-trihydrocyclopenta[1,2-d]pyrimidino[4,5-b]thiophene, ZINC00289846, AC1LG6QF, AC1Q3KVG, STOCK1S-88729, CTK4G4375, MolPort-000-145-179, HMS1579D08, SBB031745, STK838715, AKOS000122278, AB06474, AG-E-98473, MCULE-8267305059, BP-10325, KB-72330, BB 0218553, ST50050450

Molecular Formula: C9H7ClN2SMolecular Weight: 210.683280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JKXJMJPJOYMQSK-UHFFFAOYSA-N

• 2H-Indazole-3-carboxylic acid, 6-iodo-2-methyl-
IUPAC Name: 6-iodo-2-methylindazole-3-carboxylic acid | CAS Registry Number: 1086386-13-1
Synonyms: CTK0G9240, AKOS015958471, 2H-Indazole-3-carboxylicacid, 6-iodo-2-methyl-

Molecular Formula: C9H7IN2O2Molecular Weight: 302.068550 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HDQPZZQPFQBWEJ-UHFFFAOYSA-N

• 5-bromo-2-(difluoromethoxy)benzaldehyde
IUPAC Name: 5-bromo-2-(difluoromethoxy)benzaldehyde | CAS Registry Number: 329269-64-9
Synonyms: ZINC02584095, AC1Q4KOE, AC1M15TC, CTK7H8585, MolPort-001-772-918, SBB100859, AKOS001021139, AG-A-83972, MCULE-4095584751, 2-(difluoromethoxy)-5-bromobenzaldehyde, AK120005, KB-123138, EN300-07859, T5573191

Molecular Formula: C8H5BrF2O2Molecular Weight: 251.024906 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ZBACSCSIFOHNAE-UHFFFAOYSA-N

• 2-butyl-3-ethoxy-2H-indazole-6-carboxylic acid
IUPAC Name: 2-butyl-3-ethoxyindazole-6-carboxylic acid | CAS Registry Number: 919106-88-0
Synonyms: CTK3I5626, AKOS015958455, 2H-Indazole-6-carboxylicacid, 2-butyl-3-ethoxy-

Molecular Formula: C14H18N2O3Molecular Weight: 262.304320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FDZCVHSLQUUNKX-UHFFFAOYSA-N

• 1,3-dimethyl-2,4-dioxo-6-(propylamino)-1,2,3,4-tetrahydro-5-pyrimidinecarbaldehyde (CAS: 1018571-47-5)
• 2-Chlorobenzothiazole
IUPAC Name: 2-chloro-1,3-benzothiazole | CAS Registry Number: 615-20-3
Synonyms: BENZOTHIAZOLE, 2-CHLORO-, USAF EK-2784, 2-Chloro-1,3-benzothiazole, 167576_ALDRICH, WLN: T56 BN DSJ CG, NSC 8442, EINECS 210-415-0, NSC8442, AIDS019691, AIDS-019691, BRN 0116316, ZINC00152274, AI3-63118, AC 17349, LS-40712, 4-27-00-01072 (Beilstein Handbook Reference), InChI=1/C7H4ClNS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4

Molecular Formula: C7H4ClNSMolecular Weight: 169.631360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BSQLQMLFTHJVKS-UHFFFAOYSA-N

• 2-[2-[3-[(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-3H-indolium iodide
IUPAC Name: 1,3,3-trimethyl-2-[2-[3-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]indole;iodide | CAS Registry Number: 140648-15-3
Synonyms: 3H-Indolium,2-[2-[3-[2-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-,iodide (1:1), ACMC-20mzq5, CTK4C2287, CTK8G9224, AG-D-81372, 2-[2-[3-[(1,3-DIHYDRO-1,3,3-TRIMETHYL-2H-INDOL-2-YLIDENE)ETHYLIDENE]-1-CYCLOHEXEN-1-YL]ETHENYL]-1,3,3-TRIMETHYL-3H-INDOLIUM IODIDE, 3H-Indolium,2-[2-[3-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-,iodide (9CI)

Molecular Formula: C32H37IN2Molecular Weight: 576.554050 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BIQJTKZBMNPURL-UHFFFAOYSA-M

• 2-((E)-3-(5,5-Dimethyl-3-[(E)-3-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propenyl]-2-cyclohexen-1-ylidene)-1-propenyl)-1,3,3-trimethyl-3H-indolium tetrafluoroborate
IUPAC Name: 2-[(E)-3-[5,5-dimethyl-3-[(E)-3-(1,3,3-trimethylindol-1-ium-2-yl)prop-2-enylidene]cyclohexen-1-yl]prop-2-enylidene]-1,3,3-trimethylindole;tetrafluoroborate | CAS Registry Number: 410536-44-6
Synonyms: KB-161530, 2-((e)-3-(5,5-dimethyl-3-[(e)-3-(1,3,3-trimethyl-1,3-dihydro-2h-indol-2-ylidene)-1-propenyl]-2-cyclohexen-1-ylidene)-1-propenyl)-1,3,3-trimethyl-3h-indolium tetrafluoroborate

Molecular Formula: C36H43BF4N2Molecular Weight: 590.544633 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: CQVFZRVKJDHJFY-UHFFFAOYSA-N

• 3-(3-trifluoromethylphenylsulfonamido)benzoic acid
IUPAC Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid | CAS Registry Number: 613657-60-6
Synonyms: ST50134595, AC1LF530, 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoic Acid, CTK2F1764, MolPort-000-183-806, AKOS000805761, MCULE-2020683210, 3-(3-(trifluoromethyl)phenylsulfonamido)benzoic acid, T5281107, F1678-0254, 3-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)benzoic acid, Benzoicacid, 3-[[[3-(trifluoromethyl)phenyl]sulfonyl]amino]-

Molecular Formula: C14H10F3NO4SMolecular Weight: 345.293710 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: LTXNSYUJJVHELV-UHFFFAOYSA-N

• 3-(4-chloro-3-trifluoromethylphenylsulfonamido)benzoic acid
IUPAC Name: 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid | CAS Registry Number: 612041-76-6
Synonyms: 3-((4-chloro-3-(trifluoromethyl)phenyl)sulfonamido)benzoic acid, AC1NOHHL, MolPort-000-184-371, ZINC7053725, 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]benzoic Acid, AKOS000805757, MCULE-9674349737, AK473323, PB-01119638, F9995-0717, 3-(4-chloro-3-(trifluoromethyl)phenylsulfonamido)benzoic acid

Molecular Formula: C14H9ClF3NO4SMolecular Weight: 379.734 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: MYSJZHLEUFMKGZ-UHFFFAOYSA-N

• 3-(3-fluorophenylsulfonamido)benzoic acid
IUPAC Name: 3-[(3-fluorophenyl)sulfonylamino]benzoic acid | CAS Registry Number: 885269-80-7
Synonyms: 3-((3-fluorophenyl)sulfonamido)benzoic acid, 3-[(3-fluorophenyl)sulfonylamino]benzoic Acid, AC1P1I0L, SCHEMBL3724198, CTK7C2130, MolPort-001-639-330, ZINC7053723, AKOS000144250, MCULE-1177642433, AK473324, T5820108, 3-{[(3-FLUOROPHENYL)SULFONYL]AMINO}BENZOIC ACID, F9995-0720

Molecular Formula: C13H10FNO4SMolecular Weight: 295.284 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: NVLPATGVMWNAHA-UHFFFAOYSA-N

• 3-(2,5-dimethylphenylsulfonamido)benzoic acid
IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid | CAS Registry Number: 727704-68-9
Synonyms: 3-{[(2,5-dimethylphenyl)sulfonyl]amino}benzoic acid, 3-(2,5-dimethylbenzenesulfonamido)benzoic acid, F9995-0458, AC1N7BPU, AC1Q2GSJ, 3-[(2,5-dimethylphenyl)sulfonylamino]benzoic Acid, CTK6B7420, MolPort-001-639-335, SBB082051, AKOS000814154, MCULE-4314242340, NE24319, KB-108551, EN300-12972, 3-((2,5-dimethylphenyl)sulfonamido)benzoic acid, T5356940

Molecular Formula: C15H15NO4SMolecular Weight: 305.348900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GFOVIYGXYVCJAZ-UHFFFAOYSA-N

• (2E,4Z)-4-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-1-phenylbut-2-en-1-one
IUPAC Name: 4-(3-ethyl-1,3-benzothiazol-2-ylidene)-1-phenylbut-2-en-1-one | CAS Registry Number: 35327-87-8
Synonyms: (2E,4Z)-4-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)-1-PHENYLBUT-2-EN-1-ONE, CTK4H4287, AG-F-22171, 2-Buten-1-one,4-(3-ethyl-2(3H)-benzothiazolylidene)-1-phenyl-, (2E,4Z)-4-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)-1-PHENYLBUT-2-EN-1-ONE;2-BUTEN-1-ONE, 4-(3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE)-1-PHENYL-

Molecular Formula: C19H17NOSMolecular Weight: 307.409380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NZOWVNKBBLMBHB-UHFFFAOYSA-N

• 3-ethyl-2-[(E)-2-(3-{(E)-2-[3-ethyl-1,3-benzothiazol-2(3H)-ylidene]ethylidene}-2-phenyl-1-cyclopenten-1-yl)ethenyl]-1,3-benzothiazol-3-ium iodide
IUPAC Name: 3-ethyl-2-[2-[3-[2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-2-phenylcyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazole;iodide | CAS Registry Number: 70446-32-1

Molecular Formula: C33H31IN2S2Molecular Weight: 646.647110 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HKQYMSHXTBOAOL-UHFFFAOYSA-M

• 2-amino-4-thien-2-ylbenzoic acid
IUPAC Name: 2-amino-4-thiophen-2-ylbenzoic acid | CAS Registry Number: 948006-04-0
Synonyms: MolPort-006-757-989, 2-Amino-4-(2-thienyl)benzoic acid, AKOS015958389, 2-amino-4-(thiophen-2-yl)benzoic acid, F9995-0903

Molecular Formula: C11H9NO2SMolecular Weight: 219.259660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RWXQPMJFVHLSST-UHFFFAOYSA-N

• 3-(ethoxycarbonyl)-2-hydroxy-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
IUPAC Name: 3-ethoxycarbonyl-2-hydroxy-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid | CAS Registry Number: 948006-26-6
Synonyms: MolPort-006-757-998, STL302106, AKOS015958421, MCULE-9134975046, F9995-0917, 3-(Ethoxycarbonyl)-2-hydroxy-5,6,7,8-tetrahydro-1-naphthoic acid

Molecular Formula: C14H16O5Molecular Weight: 264.273840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NQDPXKMLMJUBIJ-UHFFFAOYSA-N

• 3-(4'-fluoro-1,1'-biphenyl-4-yl)propanoic acid
IUPAC Name: 3-[4-(4-fluorophenyl)phenyl]propanoic acid | CAS Registry Number: 893641-10-6
Synonyms: AC1LRDD6, SureCN1841290, CTK3E6232, AKOS004116101, 3-[4-(4-fluorophenyl)phenyl]propanoic acid, [1,1'-Biphenyl]-4-propanoicacid, 4'-fluoro-

Molecular Formula: C15H13FO2Molecular Weight: 244.260923 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: POPINLYDNNPCCT-UHFFFAOYSA-N

• 3-methyl-1-(4-nitrophenyl)piperazine
IUPAC Name: 3-methyl-1-(4-nitrophenyl)piperazine | CAS Registry Number: 329922-44-3
Synonyms: 3-Methyl-1-(4-nitro-phenyl)-piperazine, ST006463, BAS 00805293, AC1MCJW1, CBMicro_027355, Oprea1_363081, SCHEMBL5467457, CTK6C4433, TOS-BB-0544, MolPort-001-003-738, RINDRBNZJSXBCH-UHFFFAOYSA-N, ZX-AT011999, MFCD00220471, OR8378, STK041357, AKOS000288808, AKOS016344072, MCULE-9920281784, AK189521, KB-96328

Molecular Formula: C11H15N3O2Molecular Weight: 221.260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RINDRBNZJSXBCH-UHFFFAOYSA-N

• 2-AMINO-5,6-DIHYDRO-4H-CYCLOPENTA[B]THIOPHENE-3-CARBOXAMIDE
IUPAC Name: 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Molecular Formula: C8H10N2OSMolecular Weight: 182.242800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CIYGFKXNRTYHLB-UHFFFAOYSA-N

• 2-Amino-5-(2-methylphenoxy)benzoic acid
IUPAC Name: 2-amino-5-(2-methylphenoxy)benzoic acid | CAS Registry Number: 885268-00-8
Synonyms: SureCN3903979, CTK3E6218, AKOS000813851, Benzoicacid, 2-amino-5-(2-methylphenoxy)-

Molecular Formula: C14H13NO3Molecular Weight: 243.257920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XJZGSKLLSIYBQF-UHFFFAOYSA-N

• 2-Chloro-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-ethanone
IUPAC Name: 2-chloro-1-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]ethanone | CAS Registry Number: 568559-39-7
Synonyms: 2-chloro-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone, F9995-0236, 2-chloro-1-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]ethanone, ZINC03361069, AC1M82CM, AC1Q2HM1, CTK6H4620, MolPort-000-872-730, AKOS000805688, MCULE-9718218418, EN300-08109, L-4016, T0517-1451

Molecular Formula: C16H18ClNOMolecular Weight: 275.773220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QILUXTQFJBWBDG-UHFFFAOYSA-N

• 1-(5-Methoxy-1-benzofuran-3-yl)-1-ethanamine hydrochloride (CAS: 317375-60-3)
• 1-(4-Methoxyphenyl)-2-(methylsulfonyl)-1-ethanamine
IUPAC Name: 1-(4-methoxyphenyl)-2-methylsulfonylethanamine | CAS Registry Number: 885268-01-9
Synonyms: AKOS000813881, AKOS017474881, Benzenemethanamine,4-methoxy-a-[(methylsulfonyl)methyl]-

Molecular Formula: C10H15NO3SMolecular Weight: 229.296000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VTBLWYIICTUIKY-UHFFFAOYSA-N

• 2-Chloro-1-[4-(5-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-1-ethanone (CAS: 885268-10-0)
• 4-({[4-(tert-butyl)phenyl]sulfonyl}amino)benzoic acid
IUPAC Name: 4-[(4-tert-butylphenyl)sulfonylamino]benzoic acid | CAS Registry Number: 708996-17-2
Synonyms: 4-{[(4-tert-butylphenyl)sulfonyl]amino}benzoic acid, AC1MGFVZ, AC1Q1M5X, Oprea1_319188, 4-[(4-tert-butylphenyl)sulfonylamino]benzoic Acid, CTK7I8058, MolPort-000-693-338, AKOS000813633, MCULE-1638293248, NE51988, RT-009954, ST50509294, EN300-10870, 4-(4-tert-butylbenzenesulfonamido)benzoic acid, 4-((4-(tert-butyl)phenyl)sulfonamido)benzoic acid, T5286697, F3111-1614

Molecular Formula: C17H19NO4SMolecular Weight: 333.402060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: WSXARGRPZNRDBF-UHFFFAOYSA-N

• 2-{[(3-chlorophenyl)sulfonyl]amino}acetic acid
IUPAC Name: 2-[(3-chlorophenyl)sulfonylamino]acetic acid | CAS Registry Number: 565198-64-3
Synonyms: {[(3-chlorophenyl)sulfonyl]amino}acetic acid, F9995-0427, AC1M7HJO, 2-[(3-chlorophenyl)sulfonylamino]acetic Acid, MLS000773344, AC1Q763J, CHEMBL1869550, CTK7J5359, ((3-chlorophenyl)sulfonyl)glycine, MolPort-001-639-196, HMS2750M11, AKOS000813649, MCULE-3326410253, NE52295, 2-(3-chlorobenzenesulfonamido)acetic acid, SMR000364049, EN300-08383, T0517-8496

Molecular Formula: C8H8ClNO4SMolecular Weight: 249.671420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: VQWFYPPYALIWLV-UHFFFAOYSA-N

• 2-({[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}amino)acetic acid
IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]acetic acid | CAS Registry Number: 612043-42-2
Synonyms: ({[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}amino)acetic acid, ST50134215, 2-[4-chloro-3-(trifluoromethyl)benzenesulfonamido]acetic acid, AC1LQZXS, CTK7J5335, MolPort-000-184-573, 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]acetic Acid, AC1Q7636, STL307323, AKOS000116929, MCULE-8802908530, NE35633, KB-123805, EN300-08406, AB01323116-02, ((4-chloro-3-(trifluoromethyl)phenyl)sulfonyl)glycine, F1408-0220, N-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}glycine, T0518-8991

Molecular Formula: C9H7ClF3NO4SMolecular Weight: 317.669390 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: JLLFMPMRMQHVLE-UHFFFAOYSA-N

• 2-{[(3-chloro-4-fluorophenyl)sulfonyl]amino}acetic acid
IUPAC Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]acetic acid | CAS Registry Number: 613657-33-3
Synonyms: ((3-chloro-4-fluorophenyl)sulfonyl)glycine, F1408-0007, AC1LF513, ZINC74426, MolPort-000-183-772, STL306994, AKOS000805763, MCULE-5134969691, AK473121, ST50133727, N-[(3-chloro-4-fluorophenyl)sulfonyl]glycine, 2-(3-chloro-4-fluorophenylsulfonamido)acetic acid, 2-(3-chloro-4-fluorobenzenesulfonamido)acetic acid, 2-[(3-chloro-4-fluorophenyl)sulfonylamino]acetic acid

Molecular Formula: C8H7ClFNO4SMolecular Weight: 267.655 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: RCRPLYVUYSMZDL-UHFFFAOYSA-N

• 4-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid
IUPAC Name: 4-[(4-phenoxyphenyl)sulfonylamino]benzoic acid | CAS Registry Number: 302603-63-0
Synonyms: AC1LQRKP, 4-[(4-phenoxyphenyl)sulfonylamino]benzoic Acid, Oprea1_617043, Oprea1_669804, CTK1C0725, AKOS000813679, Benzoicacid, 4-[[(4-phenoxyphenyl)sulfonyl]amino]-

Molecular Formula: C19H15NO5SMolecular Weight: 369.391100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: IBMDBURJZKLTQS-UHFFFAOYSA-N

• (3-METHOXY-BENZOYLAMINO)-ACETIC ACID
IUPAC Name: 2-[(3-methoxybenzoyl)amino]acetate | CAS Registry Number: 57728-61-7
Synonyms: ZINC00126125, CID4126058

Molecular Formula: C10H10NO4-Molecular Weight: 208.190700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JPKBHIBVUXBFSZ-UHFFFAOYSA-M

• 1,2-DIPHENYL-1H-INDOLE-3-CARBALDEHYDE
IUPAC Name: 1,2-diphenylindole-3-carbaldehyde | CAS Registry Number: 29329-99-5
Synonyms: Oprea1_868105, Oprea1_871443, 1,2-Diphenyl-1H-indole-3-carbaldehyde, MolPort-000-679-739, EINECS 249-562-0, CID121813, Indole-3-carboxaldehyde, 1,2-diphenyl-, ZINC00973443, BAS 00140557, 1H-Indole-3-carboxaldehyde, 1,2-diphenyl-, AG-690/33447039, F2124-0926

Molecular Formula: C21H15NOMolecular Weight: 297.349900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VSWUURYDUFEIQQ-UHFFFAOYSA-N

• 1-BENZOTHIOPHENE-3-CARBOXYLIC ACID,2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-,ETHYL ESTER
IUPAC Name: ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | CAS Registry Number: 60442-45-7
Synonyms: ZINC02230278, AC1LXZD2, SCHEMBL11368252, STOCK1S-29085, MolPort-000-225-379, SBB038574, STK025140, AKOS000266825, MCULE-6120883493, UPCMLD0ENAT0513-9704:001, KB-296502, F0239-1019, T0513-9704, 1-BENZOTHIOPHENE-3-CARBOXYLICACID,2-[ AMINO]-4,5,6,7-TETRAHYDRO-,ETHYLESTER, ethyl 2-(3-chloropropanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxy late, ethyl 2-[(3-chloropropanoyl)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxylate, ethyl 2-[(3-chloropropanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Molecular Formula: C14H18ClNO3SMolecular Weight: 315.815620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NMBJUGPPCJLPQS-UHFFFAOYSA-N

• 2-((1E,3Z)-3-CHLORO-5-[1-ETHYL-2(1H)-QUINOLINYLIDENE]-1,3-PENTADIENYL)-1-ETHYLQUINOLINIUM 4-METHYLBENZENESULFONATE
IUPAC Name: 2-[3-chloro-5-(1-ethylquinolin-1-ium-2-yl)penta-2,4-dienylidene]-1-ethylquinoline;4-methylbenzenesulfonate | CAS Registry Number: 60684-03-9
Synonyms: CTK5B2056, AG-G-20452, NK 1143, NK 1143;QUINOLINIUM, 2-[3-CHLORO-5-(1-ETHYL-2(1H)-QUINOLINYLIDENE)-1,3-PENTADIENYL]-1-ETHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID (1:1);2-((1E,3Z)-3-CHLORO-5-[1-ETHYL-2(1H)-QUINOLINYLIDENE]-1,3-PENTADIENYL)-1-ETHYLQUINOLINIUM 4-METHYLBENZENESULFONATE

Molecular Formula: C34H33ClN2O3SMolecular Weight: 585.155420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HRHPPAUZOVOXTN-UHFFFAOYSA-M

• 3-(2-Fluorophenyl)propionic acid
IUPAC Name: 3-(2-fluorophenyl)propanoate | CAS Registry Number: 1643-26-1
Synonyms: ZINC02574331, CID2063865

Molecular Formula: C9H8FO2-Molecular Weight: 167.157023 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GUZLQEOSDXLCKX-UHFFFAOYSA-M

• 5-(4-Chloro-phenyl)-furan-2-carbaldehyde
IUPAC Name: 5-(4-chlorophenyl)furan-2-carbaldehyde | CAS Registry Number: 34035-03-5
Synonyms: 5-(4-Chlorophenyl)furfural, 428493_ALDRICH, SBB003482, ZINC00039144, 5-(4-Chlorophenyl)-2-furancarboxaldehyde, InChI=1/C11H7ClO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-7

Molecular Formula: C11H7ClO2Molecular Weight: 206.625080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ROJGJNINTRCMBL-UHFFFAOYSA-N

• 3-Fluorobenzenesulfonyl chloride
IUPAC Name: 3-fluorobenzenesulfonyl chloride | CAS Registry Number: 701-27-9
Synonyms: 3-fluorobenzene-1-sulfonyl chloride, 3-fluorobenzenesulphonyl chloride, 3-fluorobenzenesulfonylchloride, m-fluorobenzenesulfonyl chloride, 3-fluoro-benzenesulfonyl chloride, AG-G-73747, PubChem5156, AC1MC0PW, AC1Q4MRP, ACMC-209od0, chloro(3-fluorophenyl)sulfone, KSC498A4T, 532738_ALDRICH, AKOS BB-9461, CTK3J8049, BUTTPARK 33\11-49, MolPort-000-146-973, BB_SC-7347, ACN-P000619, ACN-S004470

Molecular Formula: C6H4ClFO2SMolecular Weight: 194.611163 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OKYSUJVCDXZGKE-UHFFFAOYSA-N

• 3-Bromophenanthrene
IUPAC Name: 3-bromophenanthrene | CAS Registry Number: 715-50-4
Synonyms: Phenanthrene, 3-Bromo-, NCIOpen2_005492, NSC89103, NSC 89103

Molecular Formula: C14H9BrMolecular Weight: 257.125260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BNGNNFQSUWVWCW-UHFFFAOYSA-N

• 4-Methylphenylboronic Acid
IUPAC Name: (4-methylphenyl)boronic acid | CAS Registry Number: 5720-05-8
Synonyms: p-Tolueneboronic acid, p-Tolylboronic acid, p-Methylbenzeneboronic acid, 4-Methylphenylboric acid, Boronic acid, p-tolyl-, p-Methylborophenylic acid, 4-Methylphenylboronic acid, Boronic acid, (4-methylphenyl)-, (4-methylphenyl)boronic acid, WLN: QBQR D1, 4-Methylbenzeneboronic acid, NCIOpen2_000259, 393622_ALDRICH, 90010_FLUKA, NSC 62870, BM033, ALBB-006111, NSC62870, BRN 2935970, NCGC00092015-01

Molecular Formula: C7H9BO2Molecular Weight: 135.956160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BIWQNIMLAISTBV-UHFFFAOYSA-N

• 7-Hydroxy Quinoline
IUPAC Name: 1H-quinolin-7-one | CAS Registry Number: 580-20-1
Synonyms: 7-Quinolinol, 7-HYDROXYQUINOLINE, 7-Chinolinol, quinolin-7-ol, CCRIS 4332, NCIOpen2_001114, Oprea1_760427, 7-Quinolinol (8CI,9CI), MLS000080749, NSC 87630, NSC87630, CHEBI:48980, EINECS 209-457-2, NISTC580201, BB_SC-3058, BRN 0113164, ZINC00494300, SMR000038608, LS-142475, 5-21-03-00249 (Beilstein Handbook Reference)

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QUUFTOGCVYWGNK-UHFFFAOYSA-N

• (4-Chlorophenyl)methanesulfonyl chloride
IUPAC Name: (4-chlorophenyl)methanesulfonyl chloride | CAS Registry Number: 6966-45-6
Synonyms: 4-Chlorobenzylsulfonyl chloride, 664774_ALDRICH, NSC18788, BZS-Q02-0, ALBB-001016, CID227304, 4-Chlorobenzenemethanesulfonyl chloride, p-Chloro-alpha-toluenesulfonyl chloride, (4-Chloro-phenyl)-methanesulfonyl chloride, ST5341950

Molecular Formula: C7H6Cl2O2SMolecular Weight: 225.092340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DBJRPJSDYFDWPV-UHFFFAOYSA-N

• 3-Amino-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
IUPAC Name: 5-amino-2-phenyl-4H-pyrazol-3-one | CAS Registry Number: 4149-06-8
Synonyms: TimTec1_001023, 3-Amino-1-phenyl-5-pyrazolone, 5-Pyrazolone, 3-amino-1-phenyl-, EINECS 223-974-0, NSC3336, 3-amino-1-phenyl-2-pyrazolin-5-one, AIDS026848, AIDS-026848, BRN 0153681, NSC266160, SBB003791, ZINC00061034, AI3-61273, SDCCGMLS-0066224.P001, 3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl-, NCGC00174876-01, LS-129010, 2,4-Dihydro-5-amino-2-phenyl-3H-pyrazol-3-one, 3H-Pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl-, 5-Amino-2-phenyl-1,2-dihydro-3H-pyrazol-3-one

Molecular Formula: C9H9N3OMolecular Weight: 175.187260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LPOVZHYARSAVIZ-UHFFFAOYSA-N

• 4-Chloro-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
IUPAC Name: 4-chloro-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine | CAS Registry Number: 81765-97-1
Synonyms: NSC153328, CID290237, STK279723, ZINC00078270, BAS 00569843, 4-Chloro-2-methyl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine

Molecular Formula: C11H11ClN2SMolecular Weight: 238.736440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VBBUCJFANWYVMU-UHFFFAOYSA-N

• 6-Benzothiazolol, 2-methyl-
IUPAC Name: 2-methyl-1,3-benzothiazol-6-ol | CAS Registry Number: 68867-18-5
Synonyms: 2-Methyl-1,3-benzothiazol-6-ol, 2-Methyl-6-benzothiazolol, 2-methylbenzo[d]thiazol-6-ol, 6-benzothiazolol, 2-methyl-, AG-G-66426, 6-hydroxy-2-methylbenzthiazole, ZINC00225587, PubChem17329, AC1LFSR0, SureCN906835, 6-Benzothiazolol,2-methyl-, AC1Q4W78, 6-Hydroxy-2-methylbenzothiazole, STOCK4S-01531, CTK5C8562, MolPort-001-639-069, ANW-48696, AR-1H0989, STL339381, AKOS000813812

Molecular Formula: C8H7NOSMolecular Weight: 165.212280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ROFBPPIQUBJMRO-UHFFFAOYSA-N

• 4-Aminobiphenyl
IUPAC Name: 4-phenylaniline | CAS Registry Number: 92-67-1
Synonyms: 4-Aminodiphenyl, Xenylamine, 4-BIPHENYLAMINE, p-Aminodiphenyl, p-Biphenylamine, p-Phenylaniline, p-Xenylamine, Biphenylamine, 4-Phenylaniline, p-Aminobiphenyl, biphenyl-4-amine, 4-Biphenylylamine, Paraaminodiphenyl, Aminobiphenyl, Xenylamin, Biphenyl-4-ylamine, Aniline, p-phenyl-, 4-Aminodifenil, Xenylamin [Czech], [1,1'-Biphenyl]-4-amine

Molecular Formula: C12H11NMolecular Weight: 169.222440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DMVOXQPQNTYEKQ-UHFFFAOYSA-N

• 4-Bromo-2-Thiophenecarboxylic Acid
IUPAC Name: 1-acetyl-2H-indol-3-one | CAS Registry Number: 16800-68-3
Synonyms: 1-Acetyl-3-indolinone, 1-acetylindolin-3-one, 1-Acetyl-1,2-dihydro-3H-indol-3-one, 1-acetyl-3-oxoindoline, 1-acetyl-2H-indol-3-one, 1-Acetyl-1,2-dihydro-indol-3-one, AC1LBN8I, ChemDiv2_000019, AC1Q6K6T, SureCN1048074, ACMC-1CH35, ARONIS24219, CTK4D2840, MolPort-000-690-143, BB_NC-1630, HMS1369A19, ACT03735, ANW-22325, AR-1C1297, BBL011765

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AUMJJQZNOVOCGY-UHFFFAOYSA-N

• 7-Chloro-1,2,3,4-Tetrahydroisoquinoline Hydrochloride
IUPAC Name: 7-chloro-1,2,3,4-tetrahydroisoquinoline;hydrochloride | CAS Registry Number: 73075-45-3
Synonyms: 7-CHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE, F9995-1264, SureCN1124954, CTK8B8993, MolPort-003-985-409, ACT10726, ANW-61756, AKOS015958730, RP26064, AK-30485, KB-74133, A20004, 7-Chhloro-1,2,3,4-tetrahydroisoquinoline hydrochloride

Molecular Formula: C9H11Cl2NMolecular Weight: 204.096340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: OGIAIXMUSSACDB-UHFFFAOYSA-N

• 8-Hydroxyjulolidine
Synonyms: Oprea1_302656, 249394_ALDRICH, 55455_FLUKA, ZINC03897165, JFD01514, EINECS 255-247-9, CID170474, 1H,5H-Benzo[ij]quinolizin-8-ol, 2,3,6,7-tetrahydro-, 2,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizin-8-ol, 2,3,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizin-8-ol, 1H,5H-Benzo(ij)quinolizin-8-ol, 2,3,6,7-tetrahydro-, InChI=1/C12H15NO/c14-11-6-5-9-3-1-7-13-8-2-4-10(11)12(9)13/h5-6,14H,1-4,7-8H

Molecular Formula: C12H15NOMolecular Weight: 189.253600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FOFUWJNBAQJABO-UHFFFAOYSA-N

• 4-({[(2,6-difluorophenyl)sulfonyl]amino}methyl)benzoic acid
IUPAC Name: 4-[[(2,6-difluorophenyl)sulfonylamino]methyl]benzoic acid | CAS Registry Number: 690646-12-9
Synonyms: F3394-1137, AC1LGV4U, CTK2F1774, MolPort-000-646-969, AKOS000813270, MCULE-9544044450, T5890029, 4-((2,6-difluorophenylsulfonamido)methyl)benzoic acid, 4-[[(2,6-difluorophenyl)sulfonylamino]methyl]benzoic acid, Benzoicacid, 4-[[[(2,6-difluorophenyl)sulfonyl]amino]methyl]-

Molecular Formula: C14H11F2NO4SMolecular Weight: 327.303246 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: KEAPEXOGYMGTMZ-UHFFFAOYSA-N

• 1-[(3-methoxyphenyl)sulfonyl]proline
IUPAC Name: 1-(3-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid | CAS Registry Number: 1008243-65-9
Synonyms: F3394-1133, AC1MGF9T, CBKinase1_007825, CBKinase1_020225, SCHEMBL2707091, 1-(3-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic Acid, MolPort-000-646-965, AKOS000813254, AKOS016049950, MCULE-8553977453, VU0618389-1, BRD-A40679384-001-01-4, 1-((3-methoxyphenyl)sulfonyl)pyrrolidine-2-carboxylic acid

Molecular Formula: C12H15NO5SMolecular Weight: 285.314 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: WAIYOLBUTQTIHL-UHFFFAOYSA-N


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