2-[[6-(4-methylphenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[6-(4-methylphenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-oxo-6-(p-tolyl)-2H-1,2,4-triazin-3-yl]sulfanyl]acetic acid CAS Name: 2-[[6-(4-methylphenyl)-5-oxo-2H-1,2,4-triazin-3-yl]thio]acetic acid IUPAC Name: 2-[[6-(4-methylphenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-keto-6-(p-tolyl)-2H-1,2,4-triazin-3-yl]thio]acetic acid Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCC(=O)O

InChI

InChI=1S/C12H11N3O3S/c1-7-2-4-8(5-3-7)10-11(18)13-12(15-14-10)19-6-9(16)17/h2-5H,6H2,1H3,(H,16,17)(H,13,15,18)