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CAS 64038-64-8

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Ethyl 2,3-dihydro-2-thioxo-1H-imidazole-4-carboxylate

Description:
Ethyl 2,3-dihydro-2-thioxo-1H-imidazole-4-carboxylate, with CAS number 64038-64-8, is a chemical compound characterized by its imidazole ring structure, which features a thioxo group and an ethyl ester functional group. This compound typically appears as a solid or crystalline substance and is soluble in organic solvents. Its molecular structure suggests potential reactivity due to the presence of the thioxo group, which can participate in various chemical reactions, including nucleophilic attacks and condensation reactions. The ethyl ester moiety may also undergo hydrolysis under certain conditions, leading to the formation of the corresponding carboxylic acid. Ethyl 2,3-dihydro-2-thioxo-1H-imidazole-4-carboxylate may have applications in medicinal chemistry and organic synthesis, particularly in the development of bioactive compounds. As with many imidazole derivatives, it may exhibit biological activity, although specific pharmacological properties would require further investigation. Safety data should be consulted for handling and usage, as with all chemical substances.
Formula:C6H8N2O2S
InChI:InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-7-6(11)8-4/h3H,2H2,1H3,(H2,7,8,11)
InChI key:InChIKey=PONOGPICUOALRU-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=CNC(=S)N1
Synonyms:
  • 1H-Imidazole-4-carboxylic acid, 2,3-dihydro-2-thioxo-, ethyl ester
  • 2-Mercapto-1H-imidazole-4-carboxylic acid ethyl ester
  • 4-Ethoxycarbonyl-2-mercaptoimidazole
  • Ethyl 2,3-dihydro-2-thioxo-1H-imidazole-4-carboxylate
  • Ethyl 2-mercaptoimidazole-4-carboxylate
  • Imidazole-4(or 5)-carboxylic acid, 2-mercapto-, ethyl ester
  • ethyl 2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylate
  • Ethyl 2-mercapto-1H-imidazole-4-carboxylate
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