N-(2-cyanoethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C20H19N5OS/c1-16-8-5-6-11-18(16)25-15-22-23-20(25)27-14-19(26)24(13-7-12-21)17-9-3-2-4-10-17/h2-6,8-11,15H,7,13-14H2,1H3