diethyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanedioate

Systemtic Name: diethyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanedioate Openeye Name: diethyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanedioate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanedioate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]malonic acid diethyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC1=NC(=CC(=N1)C)C

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC1=NC(=CC(=N1)C)C

InChI

InChI=1S/C13H18N2O4S/c1-5-18-11(16)10(12(17)19-6-2)20-13-14-8(3)7-9(4)15-13/h7,10H,5-6H2,1-4H3