N-(2-cyanoethyl)-2-[1-(3-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[1-(3-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[1-(3-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[1-(3-methoxyphenyl)-5-phenyl-2-imidazolyl]thio]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[1-(3-methoxyphenyl)-5-phenylimidazol-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[1-(3-methoxyphenyl)-5-phenyl-imidazol-2-yl]thio]-N-methyl-acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC=C(N1C2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC=C(N1C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H22N4O2S/c1-25(13-7-12-23)21(27)16-29-22-24-15-20(17-8-4-3-5-9-17)26(22)18-10-6-11-19(14-18)28-2/h3-6,8-11,14-15H,7,13,16H2,1-2H3