3-[4-ethyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-ethyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)pyridine CAS Name: 3-[4-ethyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)pyridine Traditional Name: 3-[5-(benzylthio)-4-ethyl-1,2,4-triazol-3-yl]pyridine Formula: C16H16N4S MolecularWeight: 296.39004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C16H16N4S/c1-2-20-15(14-9-6-10-17-11-14)18-19-16(20)21-12-13-7-4-3-5-8-13/h3-11H,2,12H2,1H3