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

Systemtic Name: 3-[4-(4-ethoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-(4-ethoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-(4-ethoxyphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-(4-ethoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-(2-phenoxyethylthio)-4-p-phenetyl-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-2-28-21-12-10-19(11-13-21)27-22(18-7-6-14-24-17-18)25-26-23(27)30-16-15-29-20-8-4-3-5-9-20/h3-14,17H,2,15-16H2,1H3