1-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 1-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidine-5-carboxylic acid Openeye Name: 1-methyl-4-oxo-2-thioxo-pyrimidine-5-carboxylic acid CAS Name: 1-methyl-4-oxo-2-sulfanylidene-5-pyrimidinecarboxylic acid IUPAC Name: 1-methyl-4-oxo-2-sulfanylidenepyrimidine-5-carboxylic acid Traditional Name: 4-keto-1-methyl-2-thioxo-pyrimidine-5-carboxylic acid Formula: C6H6N2O3S MolecularWeight: 186.18844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)NC1=S)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)NC1=S)C(=O)O

InChI

InChI=1S/C6H6N2O3S/c1-8-2-3(5(10)11)4(9)7-6(8)12/h2H,1H3,(H,10,11)(H,7,9,12)