2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(phenylmethyl)-N-propan-2-yl-ethanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(phenylmethyl)-N-propan-2-yl-ethanamide Openeye Name: N-benzyl-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-isopropyl-acetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-(phenylmethyl)-N-propan-2-ylacetamide IUPAC Name: N-benzyl-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-propan-2-ylacetamide Traditional Name: N-benzyl-2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-N-isopropyl-acetamide Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C22H24N4OS/c1-17(2)26(15-18-9-4-3-5-10-18)21(27)16-28-22-24-19-11-6-7-12-20(19)25(22)14-8-13-23/h3-7,9-12,17H,8,14-16H2,1-2H3