hexyl 2-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: hexyl 2-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)ethanoate Openeye Name: hexyl 2-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)acetate CAS Name: 2-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)acetic acid hexyl ester IUPAC Name: hexyl 2-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)acetate Traditional Name: 2-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)acetic acid hexyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC1=C(NC(=S)NC1=O)C

Isomeric SMILES

CCCCCCOC(=O)CC1=C(NC(=S)NC1=O)C

InChI

InChI=1S/C13H20N2O3S/c1-3-4-5-6-7-18-11(16)8-10-9(2)14-13(19)15-12(10)17/h3-8H2,1-2H3,(H2,14,15,17,19)