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CAS 332860-97-6

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5-[(3,4-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol

Description:
5-[(3,4-Dimethylphenoxy)methyl]-4-methyl-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) that contributes to its reactivity and potential applications in various fields, including pharmaceuticals and agriculture. The presence of the 3,4-dimethylphenoxy group enhances its lipophilicity, potentially influencing its biological activity and solubility. The methyl groups on the triazole and phenyl rings may also affect the compound's steric properties and electronic characteristics. As a triazole derivative, it may exhibit fungicidal or herbicidal properties, making it of interest in crop protection. Additionally, the thiol functionality can participate in redox reactions, which may be relevant in biochemical pathways. Overall, this compound's unique structure and functional groups suggest diverse applications, particularly in medicinal chemistry and agrochemicals.
Formula:C12H15N3OS
InChI:InChI=1/C12H15N3OS/c1-8-4-5-10(6-9(8)2)16-7-11-13-14-12(17)15(11)3/h4-6H,7H2,1-3H3,(H,14,17)
SMILES:Cc1ccc(cc1C)OCc1nnc(n1C)S
Synonyms:
  • 4H-1,2,4-Triazole-3-thiol, 5-[(3,4-dimethylphenoxy)methyl]-4-methyl-
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