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

Systemtic Name: 2-[[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 2-[[5-(m-tolylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2-[[[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2-[[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 2-[[[5-(3-methylbenzyl)-1H-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=NC(=NN2)SCC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=CC=C1)CC2=NC(=NN2)SCC3=CC=CC=N3

InChI

InChI=1S/C16H16N4S/c1-12-5-4-6-13(9-12)10-15-18-16(20-19-15)21-11-14-7-2-3-8-17-14/h2-9H,10-11H2,1H3,(H,18,19,20)