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

Systemtic Name: 4-[4-(4-ethoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(4-ethoxyphenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-ethoxyphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(4-ethoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(1-naphthylmethylthio)-4-p-phenetyl-1,2,4-triazol-3-yl]pyridine Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C26H22N4OS/c1-2-31-23-12-10-22(11-13-23)30-25(20-14-16-27-17-15-20)28-29-26(30)32-18-21-8-5-7-19-6-3-4-9-24(19)21/h3-17H,2,18H2,1H3