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CAS 669740-18-5

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5-[(4-methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Description:
5-[(4-Methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol is a chemical compound characterized by its triazole ring, which is a five-membered heterocyclic structure containing three nitrogen atoms. This compound features a thiol group (-SH), which contributes to its reactivity and potential applications in various chemical reactions, including as a reducing agent or in the formation of disulfide bonds. The presence of the methoxyphenoxy and prop-2-en-1-yl substituents enhances its structural complexity and may influence its biological activity, making it of interest in medicinal chemistry. The methoxy group can enhance lipophilicity, potentially affecting the compound's solubility and permeability in biological systems. Additionally, the compound's unique structure may confer specific pharmacological properties, making it a candidate for further research in drug development. Its CAS number, 669740-18-5, allows for easy identification and retrieval of information regarding its properties, synthesis, and applications in scientific literature.
Formula:C13H15N3O2S
InChI:InChI=1/C13H15N3O2S/c1-3-8-16-12(14-15-13(16)19)9-18-11-6-4-10(17-2)5-7-11/h3-7H,1,8-9H2,2H3,(H,15,19)
SMILES:C=CCn1c(COc2ccc(cc2)OC)nnc1S
Synonyms:
  • 4-Allyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazole-3-thiol
  • 4H-1,2,4-triazole-3-thiol, 5-[(4-methoxyphenoxy)methyl]-4-(2-propen-1-yl)-
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