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CAS 175277-94-8

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5-[[[3-(Trifluoromethyl)phenyl]methyl]thio]-1,3,4-thiadiazole-2(3H)-thione

Description:
5-[[[3-(Trifluoromethyl)phenyl]methyl]thio]-1,3,4-thiadiazole-2(3H)-thione is a chemical compound characterized by its unique structure, which includes a thiadiazole ring and a trifluoromethyl-substituted phenyl group. The presence of the thiadiazole moiety contributes to its potential biological activity, as thiadiazoles are known for their diverse pharmacological properties. The trifluoromethyl group enhances lipophilicity and can influence the compound's reactivity and interaction with biological targets. This compound is typically solid at room temperature and may exhibit moderate solubility in organic solvents. Its thione functional group indicates the presence of a sulfur atom double-bonded to a carbon atom, which can participate in various chemical reactions. The compound's CAS number, 175277-94-8, allows for precise identification in chemical databases. Overall, this substance may have applications in medicinal chemistry and agrochemicals, although specific biological activities would require further investigation through experimental studies.
Formula:C10H7F3N2S3
InChI:InChI=1S/C10H7F3N2S3/c11-10(12,13)7-3-1-2-6(4-7)5-17-9-15-14-8(16)18-9/h1-4H,5H2,(H,14,16)
InChI key:InChIKey=GYRMUGAZBJIPHZ-UHFFFAOYSA-N
SMILES:C(SC1=NNC(=S)S1)C2=CC(C(F)(F)F)=CC=C2
Synonyms:
  • 1,3,4-Thiadiazole-2(3H)-thione, 5-[[[3-(trifluoromethyl)phenyl]methyl]thio]-
  • 5-[[[3-(Trifluoromethyl)phenyl]methyl]thio]-1,3,4-thiadiazole-2(3H)-thione
  • 5-{[3-(trifluoromethyl)benzyl]sulfanyl}-1,3,4-thiadiazole-2(3H)-thione
  • Trifluoromethylbenzylthiothiadiazolethiol
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