2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-N-m-anisyl-acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CSC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CSC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C20H20N4O2S/c1-26-16-7-4-6-15(12-16)13-22-19(25)14-27-20-23-17-8-2-3-9-18(17)24(20)11-5-10-21/h2-4,6-9,12H,5,11,13-14H2,1H3,(H,22,25)