butyl (2R)-2-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate

Systemtic Name: butyl (2R)-2-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Openeye Name: butyl (2R)-2-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoate CAS Name: (2R)-2-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid butyl ester IUPAC Name: butyl (2R)-2-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Traditional Name: (2R)-2-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid butyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCOC(=O)[C@H](C)C1=C(NC(=S)NC1=O)C

InChI

InChI=1S/C12H18N2O3S/c1-4-5-6-17-11(16)7(2)9-8(3)13-12(18)14-10(9)15/h7H,4-6H2,1-3H3,(H2,13,14,15,18)/t7-/m1/s1