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

Systemtic Name: 4-[4-(2-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-benzylsulfanyl-4-(o-tolyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(2-methylphenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-benzylsulfanyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(benzylthio)-4-(o-tolyl)-1,2,4-triazol-3-yl]pyridine Formula: C21H18N4S MolecularWeight: 358.45942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C21H18N4S/c1-16-7-5-6-10-19(16)25-20(18-11-13-22-14-12-18)23-24-21(25)26-15-17-8-3-2-4-9-17/h2-14H,15H2,1H3