ethyl 1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-4-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-4-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-4-thioxo-pyrimidine-5-carboxylate CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-4-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-4-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-4-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=O)NC1=S)C2CC(C(O2)CO)O

Isomeric SMILES

CCOC(=O)C1=CN(C(=O)NC1=S)C2CC(C(O2)CO)O

InChI

InChI=1S/C12H16N2O6S/c1-2-19-11(17)6-4-14(12(18)13-10(6)21)9-3-7(16)8(5-15)20-9/h4,7-9,15-16H,2-3,5H2,1H3,(H,13,18,21)