2-methylpropyl 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate

Systemtic Name: 2-methylpropyl 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Openeye Name: isobutyl 3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoate CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid isobutyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)OCC(C)C

InChI

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