methyl 2-[2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[(3,3-dimethyl-2-oxobutyl)thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,3-dimethyl-2-oxobutyl)sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[(2-keto-3,3-dimethyl-butyl)thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC(=O)C=C(N1)CC(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC(=O)C=C(N1)CC(=O)OC

InChI

InChI=1S/C13H18N2O4S/c1-13(2,3)9(16)7-20-12-14-8(5-10(17)15-12)6-11(18)19-4/h5H,6-7H2,1-4H3,(H,14,15,17)