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CAS 491647-37-1

:

5-[(4-Chloro-3-methylphenoxy)methyl]-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Description:
5-[(4-Chloro-3-methylphenoxy)methyl]-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione, with the CAS number 491647-37-1, is a chemical compound characterized by its triazole core, which is a five-membered ring containing three nitrogen atoms. This compound features a thione functional group, indicating the presence of a sulfur atom double-bonded to a carbon atom, which contributes to its reactivity and potential biological activity. The presence of the 4-chloro-3-methylphenoxy group suggests that it may exhibit specific interactions with biological targets, potentially influencing its pharmacological properties. The ethyl group attached to the triazole ring may enhance lipophilicity, affecting its solubility and permeability. Overall, this compound's unique structure may confer various properties, making it of interest in fields such as medicinal chemistry and agrochemicals, where it could serve as a lead compound for further development. However, detailed studies would be necessary to fully elucidate its characteristics, including its stability, solubility, and biological activity.
Formula:C12H14ClN3OS
InChI:InChI=1/C12H14ClN3OS/c1-3-16-11(14-15-12(16)18)7-17-9-4-5-10(13)8(2)6-9/h4-6H,3,7H2,1-2H3,(H,15,18)
InChI key:InChIKey=YQKZBPYMQSOTAF-UHFFFAOYSA-N
SMILES:C(OC1=CC(C)=C(Cl)C=C1)C=2N(CC)C(=S)NN2
Synonyms:
  • 3H-1,2,4-Triazole-3-thione, 5-[(4-chloro-3-methylphenoxy)methyl]-4-ethyl-2,4-dihydro-
  • 4H-1,2,4-triazole-3-thiol, 5-[(4-chloro-3-methylphenoxy)methyl]-4-ethyl-
  • 5-[(4-Chloro-3-methylphenoxy)methyl]-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
  • Albb-003438
  • CHEMBRDG-BB 3018122
  • 5-[(4-Chloro-3-methylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
  • ART-CHEM-BB B018122
  • 5-[(4-chloro-3-methylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazole-3-thiol(SALTDATA: FREE)
  • TIMTEC-BB SBB009454
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