methyl 2-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)hexanoate

Systemtic Name: methyl 2-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)hexanoate Openeye Name: methyl 2-(6-hydroxy-4-oxo-2-thioxo-1H-pyrimidin-5-yl)hexanoate CAS Name: 2-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)hexanoic acid methyl ester IUPAC Name: methyl 2-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)hexanoate Traditional Name: 2-(6-hydroxy-4-keto-2-thioxo-1H-pyrimidin-5-yl)hexanoic acid methyl ester Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(NC(=S)NC1=O)O)C(=O)OC

Isomeric SMILES

CCCCC(C1=C(NC(=S)NC1=O)O)C(=O)OC

InChI

InChI=1S/C11H16N2O4S/c1-3-4-5-6(10(16)17-2)7-8(14)12-11(18)13-9(7)15/h6H,3-5H2,1-2H3,(H3,12,13,14,15,18)