diethyl 2-[[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]propanedioate

Systemtic Name: diethyl 2-[[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]propanedioate Openeye Name: diethyl 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]propanedioate CAS Name: 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]propanedioate Traditional Name: 2-[[(4S)-6-keto-4-methyl-4,5-dihydro-1H-pyrimidin-2-yl]thio]malonic acid diethyl ester Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC1=N[C@H](CC(=O)N1)C

InChI

InChI=1S/C12H18N2O5S/c1-4-18-10(16)9(11(17)19-5-2)20-12-13-7(3)6-8(15)14-12/h7,9H,4-6H2,1-3H3,(H,13,14,15)/t7-/m0/s1