3-(4-ethoxyphenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 3-(4-ethoxyphenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 3-(4-ethoxyphenyl)-4-oxo-2-thioxo-1H-pyrimidine-5-carboxylic acid CAS Name: 3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid IUPAC Name: 3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-keto-3-p-phenetyl-2-thioxo-1H-pyrimidine-5-carboxylic acid Formula: C13H12N2O4S MolecularWeight: 292.31038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC2=S)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC2=S)C(=O)O

InChI

InChI=1S/C13H12N2O4S/c1-2-19-9-5-3-8(4-6-9)15-11(16)10(12(17)18)7-14-13(15)20/h3-7H,2H2,1H3,(H,14,20)(H,17,18)