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

Systemtic Name: 3-[4-(2-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-(o-tolyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-(2-methylphenyl)-5-[[4-(methylthio)phenyl]methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-(2-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[[4-(methylthio)benzyl]thio]-4-(o-tolyl)-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4S2 MolecularWeight: 404.551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=C(C=C3)SC)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=C(C=C3)SC)C4=CN=CC=C4

InChI

InChI=1S/C22H20N4S2/c1-16-6-3-4-8-20(16)26-21(18-7-5-13-23-14-18)24-25-22(26)28-15-17-9-11-19(27-2)12-10-17/h3-14H,15H2,1-2H3