Vitas-M small molecule compound
1-{[(1H-benzimidazol-2-ylsulfanyl)methyl](benzyl)amino}-N-(4-methoxyphenyl)cyclohexanecarboxamide
Catalog ID
STK023386
SMILES COc1ccc(cc1)NC(=O)C1(CCCCC1)N(Cc1ccccc1)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 C29H32N4O2S MW 500.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O2S/c1-35-24-16-14-23(15-17-24)30-27(34)29(18-8-3-9-19-29)33(20-22-10-4-2-5-11-22)21-36-28-31-25-12-6-7-13-26(25)32-28/h2,4-7,10-17H,3,8-9,18-21H2,1H3,(H,30,34)(H,31,32)InChIKey
SUAMWWJJHGXIEQ-UHFFFAOYSA-NSynonyms
1(((1HBENZIMIDAZOL2YLSULFANYL)METHYL)(BENZYL)AMINO)N(4METHOXYPHENYL)CYCLOHEXANECARBOXAMIDE
1(1HBENZIMIDAZOL2YLSULFANYLMETHYL(BENZYL)AMINO)N(4METHOXYPHENYL)CYCLOHEXANE1CARBOXAMIDE
COC1=CC=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)CSC4=NC5=CC=CC=C5N4
COc1ccc(cc1)NC(=O)C1(CCCCC1)N(Cc1ccccc1)CSc1nc2c((nH)1)cccc2
InChI=1SC29H32N4O2Sc13524161423(151724)3027(34)29(188391929)33(2022104251122)213628312512671326(25)3228h2471017H3891821H21H3(H3034)(H3132)
MFCD03033738
STK023386
ZINC000009112977
ZINC9112977
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