Vitas-M small molecule compound

1-{[(1H-benzimidazol-2-ylsulfanyl)acetyl](4-methoxyphenyl)amino}-N-(4-methylphenyl)cyclohexanecarboxamide

Catalog ID
STL439734
SMILES COc1ccc(cc1)N(C1(CCCCC1)C(=O)Nc1ccc(cc1)C)C(=O)CSc1nc2c([nH]1)cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H32N4O3S MW 528.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O3S/c1-21-10-12-22(13-11-21)31-28(36)30(18-6-3-7-19-30)34(23-14-16-24(37-2)17-15-23)27(35)20-38-29-32-25-8-4-5-9-26(25)33-29/h4-5,8-17H,3,6-7,18-20H2,1-2H3,(H,31,36)(H,32,33)
InChIKey
GUEGNTFUHVVUSH-UHFFFAOYSA-N
Synonyms

1(((1Hbenzimidazol2ylsulfanyl)acetyl)(4methoxyphenyl)amino)N(4methylphenyl)cyclohexanecarboxamide
1(2(1HBENZO(D)IMIDAZOL2YLTHIO)N(4METHOXYPHENYL)ACETAMIDO)NPTOLYLCYCLOHEXANECARBOXAMIDE
1(N(2(1HBENZIMIDAZOL2YLSULFANYL)ACETYL)4METHOXYANILINO)N(4METHYLPHENYL)CYCLOHEXANE1CARBOXAMIDE
CC1=CC=C(C=C1)NC(=O)C2(CCCCC2)N(C3=CC=C(C=C3)OC)C(=O)CSC4=NC5=CC=CC=C5N4
COc1ccc(cc1)N(C1(CCCCC1)C(=O)Nc1ccc(cc1)C)C(=O)CSc1nc2c((nH)1)cccc2
InChI=1SC30H32N4O3Sc121101222(131121)3128(36)30(186371930)34(23141624(372)171523)27(35)2038293225845926(25)3329h45817H3671820H212H3(H3136)(H3233)
MFCD06240521
ZINC000008694961
ZINC8694961

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Available files

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