2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[5-(4-chlorophenyl)-1-(o-tolyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[[5-(4-chlorophenyl)-1-(2-methylphenyl)-2-imidazolyl]thio]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)-1-(o-tolyl)imidazol-2-yl]thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C22H21ClN4OS MolecularWeight: 424.94634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CN=C2SCC(=O)N(C)CCC#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=CN=C2SCC(=O)N(C)CCC#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H21ClN4OS/c1-16-6-3-4-7-19(16)27-20(17-8-10-18(23)11-9-17)14-25-22(27)29-15-21(28)26(2)13-5-12-24/h3-4,6-11,14H,5,13,15H2,1-2H3