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CAS 868238-05-5

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Methyl 1,2,3,6-tetrahydro-6-oxo-2-thioxo-4-pyrimidineacetate

Description:
Methyl 1,2,3,6-tetrahydro-6-oxo-2-thioxo-4-pyrimidineacetate is a chemical compound characterized by its pyrimidine ring structure, which is a six-membered aromatic ring containing nitrogen atoms. This compound features a tetrahydro configuration, indicating that it has a saturated form of the pyrimidine ring, along with a keto group (6-oxo) and a thioxo group (2-thioxo), which contribute to its reactivity and potential biological activity. The presence of the acetate group suggests that it can participate in esterification reactions and may exhibit solubility in organic solvents. Its molecular structure implies potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of functional groups that can interact with biological targets. The compound's specific properties, such as melting point, boiling point, and solubility, would depend on its molecular interactions and the environment in which it is studied. Overall, this compound represents a unique structure within the realm of pyrimidine derivatives, with implications for further research and application in various chemical fields.
Formula:C7H8N2O3S
InChI:InChI=1S/C7H8N2O3S/c1-12-6(11)3-4-2-5(10)9-7(13)8-4/h2H,3H2,1H3,(H2,8,9,10,13)
InChI key:InChIKey=OPVUEYDEWBEOLI-UHFFFAOYSA-N
SMILES:C(C(OC)=O)C1=CC(=O)NC(=S)N1
Synonyms:
  • 4-Pyrimidineacetic acid, 1,2,3,6-tetrahydro-6-oxo-2-thioxo-, methyl ester
  • Methyl 1,2,3,6-tetrahydro-6-oxo-2-thioxo-4-pyrimidineacetate
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