6-(2-methylphenyl)-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-(2-methylphenyl)-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-methylsulfanyl-6-(o-tolyl)-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-(2-methylphenyl)-2-(methylthio)-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-(2-methylphenyl)-2-methylsulfanyl-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-keto-2-(methylthio)-6-(o-tolyl)-1H-pyrimidine-5-carboxylic acid Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=O)N=C(N2)SC)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=O)N=C(N2)SC)C(=O)O

InChI

InChI=1S/C13H12N2O3S/c1-7-5-3-4-6-8(7)10-9(12(17)18)11(16)15-13(14-10)19-2/h3-6H,1-2H3,(H,17,18)(H,14,15,16)