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CAS 306936-75-4

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5-(6-Chloro-3-pyridinyl)-2,4-dihydro-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione

Description:
5-(6-Chloro-3-pyridinyl)-2,4-dihydro-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione is a chemical compound characterized by its complex structure, which includes a triazole ring, a pyridine moiety, and a trifluoromethyl-substituted phenyl group. This compound typically exhibits properties such as moderate to high solubility in organic solvents, and it may show low solubility in water due to its hydrophobic components. The presence of the chloro and trifluoromethyl groups can impart unique electronic and steric properties, potentially influencing its reactivity and biological activity. As a thione, it contains a sulfur atom double-bonded to a carbon atom, which can participate in various chemical reactions, including nucleophilic attacks. This compound may be of interest in pharmaceutical research, particularly for its potential applications in agrochemicals or as a fungicide, owing to the biological activity often associated with triazole derivatives. Safety and handling precautions should be observed, as with any chemical substance, due to potential toxicity or environmental impact.
Formula:C14H8ClF3N4S
InChI:InChI=1S/C14H8ClF3N4S/c15-11-5-4-8(7-19-11)12-20-21-13(23)22(12)10-3-1-2-9(6-10)14(16,17)18/h1-7H,(H,21,23)
InChI key:InChIKey=FUKJFXCFGLNMAL-UHFFFAOYSA-N
SMILES:S=C1N(C(=NN1)C=2C=CC(Cl)=NC2)C3=CC(C(F)(F)F)=CC=C3
Synonyms:
  • 3H-1,2,4-Triazole-3-thione, 5-(6-chloro-3-pyridinyl)-2,4-dihydro-4-[3-(trifluoromethyl)phenyl]-
  • 5-(6-Chloro-3-pyridinyl)-2,4-dihydro-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione
  • 5-(6-chloropyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
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