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

Systemtic Name: 4-[5-[(2-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-(o-tolylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2-methylphenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(2-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(2-methylbenzyl)thio]-4-phenyl-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=C1CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

InChI

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