2-[(4-oxidanyl-6-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-oxidanyl-6-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-hydroxy-6-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(4-hydroxy-6-oxo-5-phenyl-1H-pyrimidin-2-yl)thio]acetic acid IUPAC Name: 2-[(4-hydroxy-6-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-hydroxy-6-keto-5-phenyl-1H-pyrimidin-2-yl)thio]acetic acid Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(NC2=O)SCC(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(NC2=O)SCC(=O)O)O

InChI

InChI=1S/C12H10N2O4S/c15-8(16)6-19-12-13-10(17)9(11(18)14-12)7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16)(H2,13,14,17,18)