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

Systemtic Name: N-(2-cyanoethyl)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]-N-methyl-acetamide Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N(C)CCC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N(C)CCC#N)C

InChI

InChI=1S/C17H20N4OS/c1-13-9-14(2)11-15(10-13)21-8-6-19-17(21)23-12-16(22)20(3)7-4-5-18/h6,8-11H,4,7,12H2,1-3H3