2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-[(3,4-dimethoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-N-methyl-N-veratryl-acetamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S/c1-25(14-16-9-10-19(28-2)20(13-16)29-3)21(27)15-30-22-24-17-7-4-5-8-18(17)26(22)12-6-11-23/h4-5,7-10,13H,6,12,14-15H2,1-3H3