2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2-[[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 2-[[(5-p-anisyl-1H-1,2,4-triazol-3-yl)thio]methyl]pyridine Formula: C16H16N4OS MolecularWeight: 312.38944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=CC=N3

InChI

InChI=1S/C16H16N4OS/c1-21-14-7-5-12(6-8-14)10-15-18-16(20-19-15)22-11-13-4-2-3-9-17-13/h2-9H,10-11H2,1H3,(H,18,19,20)