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

Systemtic Name: 2-[4-ethyl-3-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-ethyl-3-(p-tolyl)-5-thioxo-1,2,4-triazol-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-ethyl-3-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethylacetamide IUPAC Name: 2-[4-ethyl-3-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-ethyl-3-(p-tolyl)-5-thioxo-1,2,4-triazol-1-yl]-N-phenethyl-acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN(C1=S)CC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H24N4OS/c1-3-24-20(18-11-9-16(2)10-12-18)23-25(21(24)27)15-19(26)22-14-13-17-7-5-4-6-8-17/h4-12H,3,13-15H2,1-2H3,(H,22,26)