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CAS 796067-45-3

:

5-Cyano-4-mercapto-2-methyl-N-phenyl-3-azaspiro[5.5]undeca-1,4-diene-1-carboxamide

Description:
5-Cyano-4-mercapto-2-methyl-N-phenyl-3-azaspiro[5.5]undeca-1,4-diene-1-carboxamide is a complex organic compound characterized by its unique spirocyclic structure, which includes a combination of azaspiro and diene functionalities. The presence of a cyano group and a mercapto group contributes to its reactivity and potential applications in various chemical reactions. The compound features a phenyl group, which can enhance its lipophilicity and influence its interaction with biological systems. Its carboxamide functional group may impart hydrogen bonding capabilities, affecting solubility and stability. This compound is of interest in medicinal chemistry and material science due to its potential biological activity and structural properties. As with many organic compounds, its physical properties, such as melting point, boiling point, and solubility, would depend on the specific conditions and environment. Safety data and handling precautions should be considered, as compounds with similar structures may exhibit toxicity or reactivity. Further studies would be necessary to fully elucidate its properties and potential applications.
Formula:C19H21N3OS
InChI:InChI=1S/C19H21N3OS/c1-13-16(17(23)22-14-8-4-2-5-9-14)19(10-6-3-7-11-19)15(12-20)18(24)21-13/h2,4-5,8-9,21,24H,3,6-7,10-11H2,1H3,(H,22,23)
InChI key:InChIKey=JUTVYLYWKQBDJI-UHFFFAOYSA-N
SMILES:C(NC1=CC=CC=C1)(=O)C=2C3(C(C#N)=C(S)NC2C)CCCCC3
Synonyms:
  • 3-Azaspiro[5.5]undeca-1,4-diene-1-carboxamide, 5-cyano-4-mercapto-2-methyl-N-phenyl-
  • 5-Cyano-4-mercapto-2-methyl-N-phenyl-3-azaspiro[5.5]undeca-1,4-diene-1-carboxamide
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