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

Systemtic Name: 4-[4-(4-ethoxyphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-benzylsulfanyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-ethoxyphenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-benzylsulfanyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(benzylthio)-4-p-phenetyl-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H20N4OS/c1-2-27-20-10-8-19(9-11-20)26-21(18-12-14-23-15-13-18)24-25-22(26)28-16-17-6-4-3-5-7-17/h3-15H,2,16H2,1H3