N-[(1S,2S)-2-methylcyclohexyl]-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[1-(p-tolyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[[1-(4-methylphenyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[[1-(p-tolyl)benzimidazol-2-yl]thio]acetamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)C

InChI

InChI=1S/C23H27N3OS/c1-16-11-13-18(14-12-16)26-21-10-6-5-9-20(21)25-23(26)28-15-22(27)24-19-8-4-3-7-17(19)2/h5-6,9-14,17,19H,3-4,7-8,15H2,1-2H3,(H,24,27)/t17-,19-/m0/s1