[5-(1-butoxybutyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl] ethanoate

Systemtic Name: [5-(1-butoxybutyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl] ethanoate Openeye Name: [5-(1-butoxybutyl)-4-oxo-2-thioxo-1H-pyrimidin-6-yl] acetate CAS Name: acetic acid [5-(1-butoxybutyl)-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl] ester IUPAC Name: [5-(1-butoxybutyl)-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl] acetate Traditional Name: acetic acid [5-(1-butoxybutyl)-4-keto-2-thioxo-1H-pyrimidin-6-yl] ester Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(CCC)C1=C(NC(=S)NC1=O)OC(=O)C

Isomeric SMILES

CCCCOC(CCC)C1=C(NC(=S)NC1=O)OC(=O)C

InChI

InChI=1S/C14H22N2O4S/c1-4-6-8-19-10(7-5-2)11-12(18)15-14(21)16-13(11)20-9(3)17/h10H,4-8H2,1-3H3,(H2,15,16,18,21)