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

Systemtic Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)propanamide Openeye Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(p-tolyl)propanamide CAS Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(4-methylphenyl)propanamide IUPAC Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)propanamide Traditional Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(p-tolyl)propionamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCCC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCCC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4OS/c1-3-18-22-23-20(24(18)17-7-5-4-6-8-17)26-14-13-19(25)21-16-11-9-15(2)10-12-16/h4-12H,3,13-14H2,1-2H3,(H,21,25)