N-(2-cyanoethyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H19N5OS MolecularWeight: 329.41996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCCC#N)C2=CC=CC=C2C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCCC#N)C2=CC=CC=C2C

InChI

InChI=1S/C16H19N5OS/c1-3-21-15(13-8-5-4-7-12(13)2)19-20-16(21)23-11-14(22)18-10-6-9-17/h4-5,7-8H,3,6,10-11H2,1-2H3,(H,18,22)