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CAS 174573-90-1

:

2,4-Dihydro-5-(3-methoxyphenyl)-4-phenyl-3H-1,2,4-triazole-3-thione

Description:
2,4-Dihydro-5-(3-methoxyphenyl)-4-phenyl-3H-1,2,4-triazole-3-thione, identified by its CAS number 174573-90-1, is a chemical compound belonging to the class of triazoles, which are five-membered heterocyclic compounds containing three nitrogen atoms. This particular 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 methoxyphenyl and phenyl substituents enhance its lipophilicity, potentially influencing its solubility and interaction with biological systems. The compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry and agricultural applications. Its structural characteristics suggest potential applications in the development of fungicides or other agrochemicals, as well as in the synthesis of novel pharmaceuticals. However, specific biological activity, toxicity, and environmental impact would require further investigation through empirical studies.
Formula:C15H13N3OS
InChI:InChI=1S/C15H13N3OS/c1-19-13-9-5-6-11(10-13)14-16-17-15(20)18(14)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,20)
InChI key:InChIKey=BZWWZZJEHWWCAE-UHFFFAOYSA-N
SMILES:S=C1N(C(=NN1)C2=CC(OC)=CC=C2)C3=CC=CC=C3
Synonyms:
  • 2,4-Dihydro-5-(3-methoxyphenyl)-4-phenyl-3H-1,2,4-triazole-3-thione
  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(3-methoxyphenyl)-4-phenyl-
  • 4H-1,2,4-Triazole-3-thiol, 5-(3-methoxyphenyl)-4-phenyl-
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