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

Systemtic Name: 4-[4-(4-ethylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(4-ethylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-ethylphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(4-ethylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-(4-ethylphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4OS/c1-2-18-8-10-20(11-9-18)27-22(19-12-14-24-15-13-19)25-26-23(27)29-17-16-28-21-6-4-3-5-7-21/h3-15H,2,16-17H2,1H3