1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Openeye Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-benzyl-amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide CAS Name: 1-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]-(phenylmethyl)amino]-N-(4-methoxyphenyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-benzylamino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Traditional Name: 1-[[2-(1H-benzimidazol-2-ylthio)acetyl]-benzyl-amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide Formula: C30H32N4O3S MolecularWeight: 528.66508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C30H32N4O3S/c1-37-24-16-14-23(15-17-24)31-28(36)30(18-8-3-9-19-30)34(20-22-10-4-2-5-11-22)27(35)21-38-29-32-25-12-6-7-13-26(25)33-29/h2,4-7,10-17H,3,8-9,18-21H2,1H3,(H,31,36)(H,32,33)