2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-phenethyl-acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CN1C=NN=C1SCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C13H16N4OS/c1-17-10-15-16-13(17)19-9-12(18)14-8-7-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,14,18)