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

Systemtic Name: ethyl 2-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)hexanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4S/c1-3-5-6-7(11(17)18-4-2)8-9(15)13-12(19)14-10(8)16/h7H,3-6H2,1-2H3,(H3,13,14,15,16,19)