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

Systemtic Name: N-(cyanomethyl)-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-(cyanomethyl)-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-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-(cyanomethyl)-N-phenylacetamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(cyanomethyl)-N-phenyl-acetamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4OS/c1-16-19(14-17-8-4-2-5-9-17)24-21(23-16)27-15-20(26)25(13-12-22)18-10-6-3-7-11-18/h2-11H,13-15H2,1H3,(H,23,24)