N-(2-cyanoethyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)N(CCC#N)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)N(CCC#N)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N4OS/c1-17-20(15-18-9-4-2-5-10-18)25-22(24-17)28-16-21(27)26(14-8-13-23)19-11-6-3-7-12-19/h2-7,9-12H,8,14-16H2,1H3,(H,24,25)