methyl 4-(2-methylsulfanylpyrimidin-4-yl)-2,4-bis(oxidanylidene)butanoate

Systemtic Name: methyl 4-(2-methylsulfanylpyrimidin-4-yl)-2,4-bis(oxidanylidene)butanoate Openeye Name: methyl 4-(2-methylsulfanylpyrimidin-4-yl)-2,4-dioxo-butanoate CAS Name: 4-[2-(methylthio)-4-pyrimidinyl]-2,4-dioxobutanoic acid methyl ester IUPAC Name: methyl 4-(2-methylsulfanylpyrimidin-4-yl)-2,4-dioxobutanoate Traditional Name: 2,4-diketo-4-[2-(methylthio)pyrimidin-4-yl]butyric acid methyl ester Formula: C10H10N2O4S MolecularWeight: 254.2624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)CC(=O)C1=NC(=NC=C1)SC

Isomeric SMILES

COC(=O)C(=O)CC(=O)C1=NC(=NC=C1)SC

InChI

InChI=1S/C10H10N2O4S/c1-16-9(15)8(14)5-7(13)6-3-4-11-10(12-6)17-2/h3-4H,5H2,1-2H3