N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]ethanamide

Systemtic Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]ethanamide Openeye Name: N-[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]acetamide CAS Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]ethyl]acetamide IUPAC Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]acetamide Traditional Name: N-[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]ethyl]acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCCNC(=O)C

InChI

InChI=1S/C13H16N4OS/c1-9-3-5-11(6-4-9)12-15-13(17-16-12)19-8-7-14-10(2)18/h3-6H,7-8H2,1-2H3,(H,14,18)(H,15,16,17)