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CAS 309726-20-3

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

Description:
4-Methyl-5-[(4-methylphenoxy)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 agriculture and pharmaceuticals. The presence of the 4-methylphenoxy group enhances its lipophilicity, potentially improving its ability to penetrate biological membranes. The compound's structure suggests 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 biological systems or as a part of synthetic pathways. Overall, this compound's unique structural features and functional groups suggest a range of potential applications, particularly in agrochemicals and medicinal chemistry, although specific biological activities would require further investigation.
Formula:C11H13N3OS
InChI:InChI=1/C11H13N3OS/c1-8-3-5-9(6-4-8)15-7-10-12-13-11(16)14(10)2/h3-6H,7H2,1-2H3,(H,13,16)
SMILES:Cc1ccc(cc1)OCc1nnc(n1C)S
Synonyms:
  • 4H-1,2,4-triazole-3-thiol, 4-methyl-5-[(4-methylphenoxy)methyl]-
  • EU-0085729
  • Albb-003395
  • A2222/0093579
  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-5-[(4-methylphenoxy)methyl]-
  • CHEMBRDG-BB 3018077
  • 4-methyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol(SALTDATA: FREE)
  • 4-Methyl-5-((p-tolyloxy)methyl)-4h-1,2,4-triazole-3-thiol
  • AKOS BBS-00003409
  • ZINC00269002
  • See more synonyms
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