4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine

Systemtic Name: 4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Openeye Name: 4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine CAS Name: 4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine IUPAC Name: 4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Traditional Name: 4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC2=CC=NC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCCC2=CC=NC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H18N4OS/c1-21-16(14-3-5-15(22-2)6-4-14)19-20-17(21)23-12-9-13-7-10-18-11-8-13/h3-8,10-11H,9,12H2,1-2H3