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CAS 735322-62-0

:

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

Description:
5-(2,5-Dichlorophenyl)-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. This substance features a dichlorophenyl group, contributing to its potential biological activity and lipophilicity. 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 biological targets. The compound is likely to be a solid at room temperature and may have moderate solubility in organic solvents. Its unique structure suggests potential applications in pharmaceuticals or agrochemicals, particularly in the development of fungicides or herbicides. Additionally, the dichlorophenyl moiety may enhance its efficacy and selectivity in biological systems. As with many triazole derivatives, it may also exhibit antifungal properties, making it of interest in medicinal chemistry. Safety and handling precautions should be observed due to the presence of chlorine atoms, which can impart toxicity.
Formula:C8H5Cl2N3S
InChI:InChI=1S/C8H5Cl2N3S/c9-4-1-2-6(10)5(3-4)7-11-8(14)13-12-7/h1-3H,(H2,11,12,13,14)
InChI key:InChIKey=NMMKMPMKLSTYQX-UHFFFAOYSA-N
SMILES:ClC1=C(C=C(Cl)C=C1)C=2NC(=S)NN2
Synonyms:
  • 3H-1,2,4-Triazole-3-thione, 5-(2,5-dichlorophenyl)-1,2-dihydro-
  • 5-(2,5-Dichlorophenyl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
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