2-[2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-cyclohexyl-ethanamide Openeye Name: 2-[2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]-N-cyclohexyl-acetamide CAS Name: 2-[2-[[2-(1-azepanyl)-2-oxoethyl]thio]-1-benzimidazolyl]-N-cyclohexylacetamide IUPAC Name: 2-[2-[2-(azepan-1-yl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]-N-cyclohexylacetamide Traditional Name: 2-[2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]benzimidazol-1-yl]-N-cyclohexyl-acetamide Formula: C23H32N4O2S MolecularWeight: 428.59078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NC4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NC4CCCCC4

InChI

InChI=1S/C23H32N4O2S/c28-21(24-18-10-4-3-5-11-18)16-27-20-13-7-6-12-19(20)25-23(27)30-17-22(29)26-14-8-1-2-9-15-26/h6-7,12-13,18H,1-5,8-11,14-17H2,(H,24,28)