methyl 4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=S)NC1=O

Isomeric SMILES

COC(=O)C1=CNC(=S)NC1=O

InChI

InChI=1S/C6H6N2O3S/c1-11-5(10)3-2-7-6(12)8-4(3)9/h2H,1H3,(H2,7,8,9,12)