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

Systemtic Name: 4-[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Openeye Name: 4-[2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine CAS Name: 4-[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine IUPAC Name: 4-[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Traditional Name: 4-[2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]ethyl]pyridine Formula: C22H20N4S MolecularWeight: 372.486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCCC3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCCC3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4S/c1-17-7-9-20(10-8-17)26-21(19-5-3-2-4-6-19)24-25-22(26)27-16-13-18-11-14-23-15-12-18/h2-12,14-15H,13,16H2,1H3