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

Systemtic Name: 2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[[1-(3-chlorophenyl)-5-phenyl-2-imidazolyl]thio]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[1-(3-chlorophenyl)-5-phenylimidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C21H19ClN4OS MolecularWeight: 410.91976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN4OS/c1-25(12-6-11-23)20(27)15-28-21-24-14-19(16-7-3-2-4-8-16)26(21)18-10-5-9-17(22)13-18/h2-5,7-10,13-14H,6,12,15H2,1H3