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

Systemtic Name: 4-[4-ethyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-ethyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-ethyl-5-[(3-methylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-ethyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-ethyl-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C17H18N4S MolecularWeight: 310.41662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C3=CC=NC=C3

InChI

InChI=1S/C17H18N4S/c1-3-21-16(15-7-9-18-10-8-15)19-20-17(21)22-12-14-6-4-5-13(2)11-14/h4-11H,3,12H2,1-2H3