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

Systemtic Name: 4-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(4-ethoxyphenyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(2-methylbenzyl)thio]-4-p-phenetyl-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4OS/c1-3-28-21-10-8-20(9-11-21)27-22(18-12-14-24-15-13-18)25-26-23(27)29-16-19-7-5-4-6-17(19)2/h4-15H,3,16H2,1-2H3