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

Systemtic Name: N-(2-cyanoethyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-N-phenylpropanamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenylpropanamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(2-cyanoethyl)-N-phenyl-propionamide Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N4OS/c1-17-21(16-19-10-5-3-6-11-19)26-23(25-17)29-18(2)22(28)27(15-9-14-24)20-12-7-4-8-13-20/h3-8,10-13,18H,9,15-16H2,1-2H3,(H,25,26)