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CAS 774-07-2

:

Ethyl 6-amino-1,2-dihydro-2-thioxo-5-pyrimidinecarboxylate

Description:
Ethyl 6-amino-1,2-dihydro-2-thioxo-5-pyrimidinecarboxylate, with the CAS number 774-07-2, is a chemical compound that belongs to the class of pyrimidine derivatives. It features a pyrimidine ring with a thioxo group and an ethyl ester functional group, contributing to its unique reactivity and properties. The presence of the amino group enhances its potential for forming hydrogen bonds, making it a candidate for various biological activities. This compound is typically characterized by its solid state at room temperature and may exhibit moderate solubility in polar solvents due to the presence of the carboxylate group. Ethyl 6-amino-1,2-dihydro-2-thioxo-5-pyrimidinecarboxylate is of interest in medicinal chemistry for its potential applications in drug development, particularly in the synthesis of biologically active molecules. Its structural features suggest it may participate in various chemical reactions, including nucleophilic substitutions and condensation reactions, which are common in organic synthesis.
Formula:C7H9N3O2S
InChI:InChI=1S/C7H9N3O2S/c1-2-12-6(11)4-3-9-7(13)10-5(4)8/h3H,2H2,1H3,(H3,8,9,10,13)
InChI key:InChIKey=DKTWKRWWQKVQQB-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(N)NC(=S)N=C1
Synonyms:
  • 4-Amino-2-mercaptopyrimidine-5-carboxylic acid ethyl ester
  • 5-Pyrimidinecarboxylic acid, 4-amino-1,2-dihydro-2-thioxo-, ethyl ester
  • 5-Pyrimidinecarboxylic acid, 4-amino-2-mercapto-, ethyl ester
  • 5-Pyrimidinecarboxylic acid, 6-amino-1,2-dihydro-2-thioxo-, ethyl ester
  • Ethyl 6-Amino-2-Thioxo-1,2-Dihydropyrimidine-5-Carboxylate
  • Ethyl 6-amino-1,2-dihydro-2-thioxo-5-pyrimidinecarboxylate
  • NSC 9308
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