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CAS 26028-65-9

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

Description:
5-(4-Chlorophenyl)-1,2-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. The presence of the 4-chlorophenyl group indicates that there is a chlorinated phenyl substituent attached to the triazole, contributing to its potential biological activity and chemical reactivity. This compound typically exhibits properties such as moderate solubility in organic solvents and may show varying degrees of stability depending on environmental conditions. It is often studied for its potential applications in pharmaceuticals, agrochemicals, and as a building block in organic synthesis. The thione functional group (–C=S) suggests that it may participate in various chemical reactions, including nucleophilic attacks and coordination with metal ions. Overall, the unique structural features of this compound make it of interest in both synthetic and medicinal chemistry.
Formula:C8H6ClN3S
InChI:InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)
InChI key:InChIKey=NHEHIODVWGKDFV-UHFFFAOYSA-N
SMILES:S=C1NC(C2=CC=C(Cl)C=C2)=NN1
Synonyms:
  • 3H-1,2,4-Triazole-3-thione, 5-(4-chlorophenyl)-1,2-dihydro-
  • 5-(4-Chlorophenyl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
  • 5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
  • 5-(p-Chlorophenyl)-1,2,4-triazole-3-thiol
  • Chlorophenyltriazolethiol
  • s-Triazole-3-thiol, 5-(p-chlorophenyl)-
  • 3-(4-Chlorophenyl)-1,2,4-triazole-5-thiol
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