N-[2-(4-methylphenyl)sulfanylethyl]-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-(1,2,4-triazol-1-yl)-3-pyridinecarboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide Traditional Name: N-[2-(p-tolylthio)ethyl]-2-(1,2,4-triazol-1-yl)nicotinamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=C(N=CC=C2)N3C=NC=N3

InChI

InChI=1S/C17H17N5OS/c1-13-4-6-14(7-5-13)24-10-9-20-17(23)15-3-2-8-19-16(15)22-12-18-11-21-22/h2-8,11-12H,9-10H2,1H3,(H,20,23)