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

Systemtic Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-phenyl-amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Openeye Name: 1-(N-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]anilino)-N-(4-methoxyphenyl)cyclohexanecarboxamide CAS Name: 1-(N-[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]anilino)-N-(4-methoxyphenyl)-1-cyclohexanecarboxamide IUPAC Name: 1-(N-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]anilino)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Traditional Name: 1-(N-[2-(1H-benzimidazol-2-ylthio)acetyl]anilino)-N-(4-methoxyphenyl)cyclohexanecarboxamide Formula: C29H30N4O3S MolecularWeight: 514.6385

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N4O3S/c1-36-23-16-14-21(15-17-23)30-27(35)29(18-8-3-9-19-29)33(22-10-4-2-5-11-22)26(34)20-37-28-31-24-12-6-7-13-25(24)32-28/h2,4-7,10-17H,3,8-9,18-20H2,1H3,(H,30,35)(H,31,32)