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

Systemtic Name: 3-[4-(2-methylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-(o-tolyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-(2-methylphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-(2-methylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-(o-tolyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H20N4OS/c1-17-8-5-6-12-20(17)26-21(18-9-7-13-23-16-18)24-25-22(26)28-15-14-27-19-10-3-2-4-11-19/h2-13,16H,14-15H2,1H3