3-(5-methoxy-2-sulfanyl-phenyl)-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 3-(5-methoxy-2-sulfanyl-phenyl)-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carboxylic acid Openeye Name: 3-(5-methoxy-2-sulfanyl-phenyl)-2,4-dioxo-1H-pyrimidine-5-carboxylic acid CAS Name: 3-(2-mercapto-5-methoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 3-(5-methoxy-2-sulfanylphenyl)-2,4-dioxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2,4-diketo-3-(2-mercapto-5-methoxy-phenyl)-1H-pyrimidine-5-carboxylic acid Formula: C12H10N2O5S MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S)N2C(=O)C(=CNC2=O)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)S)N2C(=O)C(=CNC2=O)C(=O)O

InChI

InChI=1S/C12H10N2O5S/c1-19-6-2-3-9(20)8(4-6)14-10(15)7(11(16)17)5-13-12(14)18/h2-5,20H,1H3,(H,13,18)(H,16,17)