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

Systemtic Name: N-(cyanomethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N5OS/c1-15-7-5-6-10-17(15)24-14-21-22-19(24)26-13-18(25)23(12-11-20)16-8-3-2-4-9-16/h2-10,14H,12-13H2,1H3