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CAS 20939-16-6

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4-Amino-5-ethyl-4H-1,2,4-triazole-3-thiol

Description:
4-Amino-5-ethyl-4H-1,2,4-triazole-3-thiol, with the CAS number 20939-16-6, is a heterocyclic compound featuring a triazole ring, which is characterized by its three nitrogen atoms and two carbon atoms. This compound contains an amino group (-NH2) and a thiol group (-SH), contributing to its reactivity and potential applications in various fields. It is typically a solid at room temperature and may exhibit solubility in polar solvents due to the presence of the amino and thiol functional groups. The thiol group can participate in redox reactions, making this compound of interest in medicinal chemistry and agricultural applications, particularly as a potential fungicide or herbicide. Additionally, the presence of the ethyl group enhances its lipophilicity, which may influence its biological activity and interaction with other molecules. Safety data should be consulted for handling and usage, as compounds containing thiol groups can be sensitive to oxidation and may have specific toxicity profiles.
Formula:C4H8N4S
InChI:InChI=1S/C4H8N4S/c1-2-3-6-7-4(9)8(3)5/h2,5H2,1H3,(H,7,9)
InChI key:InChIKey=NHJQUZUFQOQBNE-UHFFFAOYSA-N
SMILES:C(C)C=1N(N)C(=S)NN1
Synonyms:
  • Δ2-1,2,4-Triazoline-5-thione, 4-amino-3-ethyl-
  • 3H-1,2,4-Triazole-3-thione, 4-amino-5-ethyl-2,4-dihydro-
  • 4-Amino-5-ethyl-s-triazole-3-thiol
  • 4H-1,2,4-Triazole-3-thiol, 4-amino-5-ethyl-
  • 4-Amino-5-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
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