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CAS 23282-94-2

:

4-benzyl-5-(2-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Description:
4-benzyl-5-(2-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is a chemical compound characterized by its triazole ring structure, which is a five-membered heterocyclic compound containing three nitrogen atoms. This substance features a benzyl group and a 2-chlorophenyl substituent, contributing to its potential biological activity and chemical reactivity. The presence of the thione functional group (–C=S) indicates that it may exhibit properties similar to thioketones, potentially influencing its reactivity and interactions with other molecules. The compound is likely to be a solid at room temperature, with moderate solubility in organic solvents, which is typical for many triazole derivatives. Its unique structure suggests potential applications in pharmaceuticals, particularly in the development of antifungal or antimicrobial agents, as triazoles are known for their biological significance. However, specific properties such as melting point, boiling point, and spectral data would require experimental determination or literature reference for precise characterization.
Formula:C15H12ClN3S
InChI:InChI=1/C15H12ClN3S/c16-13-9-5-4-8-12(13)14-17-18-15(20)19(14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,20)
SMILES:c1ccc(cc1)Cn1c(c2ccccc2Cl)nnc1S
Synonyms:
  • 4-Benzyl-5-(2-chloro-phenyl)-4H-[1,2,4]triazole-3-thiol
  • 4-Benzyl-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
  • 4H-1,2,4-triazole-3-thiol, 5-(2-chlorophenyl)-4-(phenylmethyl)-
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