methyl 2-[5-cyano-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]thiophene-3-carboxylate

Systemtic Name: methyl 2-[5-cyano-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]thiophene-3-carboxylate Openeye Name: methyl 2-(5-cyano-3-methyl-2,4-dioxo-pyrimidin-1-yl)thiophene-3-carboxylate CAS Name: 2-(5-cyano-3-methyl-2,4-dioxo-1-pyrimidinyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(5-cyano-3-methyl-2,4-dioxopyrimidin-1-yl)thiophene-3-carboxylate Traditional Name: 2-(5-cyano-2,4-diketo-3-methyl-pyrimidin-1-yl)thiophene-3-carboxylic acid methyl ester Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN(C1=O)C2=C(C=CS2)C(=O)OC)C#N

Isomeric SMILES

CN1C(=O)C(=CN(C1=O)C2=C(C=CS2)C(=O)OC)C#N

InChI

InChI=1S/C12H9N3O4S/c1-14-9(16)7(5-13)6-15(12(14)18)10-8(3-4-20-10)11(17)19-2/h3-4,6H,1-2H3