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

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(phenylmethyl)carbamoyl]ethanamide Openeye Name: N-(benzylcarbamoyl)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-[oxo-[(phenylmethyl)amino]methyl]acetamide IUPAC Name: N-(benzylcarbamoyl)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(benzylcarbamoyl)-2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]acetamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O2S/c21-11-6-12-25-17-10-5-4-9-16(17)23-20(25)28-14-18(26)24-19(27)22-13-15-7-2-1-3-8-15/h1-5,7-10H,6,12-14H2,(H2,22,24,26,27)