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CAS 725217-55-0

:

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

Description:
5-(3,4-Dichlorophenyl)-2,4-dihydro-4-(2-propen-1-yl)-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 a thione functional group (–C=S) indicates that it may exhibit unique reactivity and properties compared to its corresponding thiol or sulfonyl derivatives. The compound's structure includes a propenyl substituent, which may enhance its reactivity and interactions with biological targets. It is often studied for its potential applications in agriculture, particularly as a fungicide or herbicide, due to its ability to inhibit specific enzymatic pathways in plants or pathogens. The compound's solubility, stability, and reactivity can vary based on environmental conditions, making it important to consider these factors in practical applications. Overall, this compound represents a class of triazole derivatives that are of interest in both synthetic chemistry and agricultural science.
Formula:C11H9Cl2N3S
InChI:InChI=1S/C11H9Cl2N3S/c1-2-5-16-10(14-15-11(16)17)7-3-4-8(12)9(13)6-7/h2-4,6H,1,5H2,(H,15,17)
InChI key:InChIKey=MRLFJUYOVZAQLK-UHFFFAOYSA-N
SMILES:C(C=C)N1C(=NNC1=S)C2=CC(Cl)=C(Cl)C=C2
Synonyms:
  • 3H-1,2,4-Triazole-3-thione, 5-(3,4-dichlorophenyl)-2,4-dihydro-4-(2-propen-1-yl)-
  • 3H-1,2,4-Triazole-3-thione, 5-(3,4-dichlorophenyl)-2,4-dihydro-4-(2-propenyl)-
  • 4-Allyl-5-(3,4-dichlorophenyl)-4H-1,2,4-triazole-3-thiol
  • 4H-1,2,4-triazole-3-thiol, 5-(3,4-dichlorophenyl)-4-(2-propen-1-yl)-
  • 5-(3,4-Dichlorophenyl)-2,4-dihydro-4-(2-propen-1-yl)-3H-1,2,4-triazole-3-thione
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