ethyl 4-(1-ethoxy-1-oxidanylidene-butan-2-yl)sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(1-ethoxy-1-oxidanylidene-butan-2-yl)sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(1-ethoxycarbonylpropylsulfanyl)-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 4-[(1-ethoxy-1-oxobutan-2-yl)thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-ethoxy-1-oxobutan-2-yl)sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-(1-carbethoxypropylthio)-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)SC1=NC(=O)NC(=C1C(=O)OCC)C

Isomeric SMILES

CCC(C(=O)OCC)SC1=NC(=O)NC(=C1C(=O)OCC)C

InChI

InChI=1S/C14H20N2O5S/c1-5-9(12(17)20-6-2)22-11-10(13(18)21-7-3)8(4)15-14(19)16-11/h9H,5-7H2,1-4H3,(H,15,16,19)