CymitQuimica logo

CAS 322412-27-1

:

5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Description:
5-(3-Methylphenyl)-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) that contributes to its reactivity and potential applications in various fields, including pharmaceuticals and agrochemicals. The presence of a 3-methylphenyl group and a prop-2-en-1-yl substituent enhances its molecular complexity and may influence its biological activity and solubility. The compound's structure suggests potential for interactions with biological targets, making it of interest in medicinal chemistry. Additionally, the thiol group can participate in redox reactions, which may be relevant in biochemical processes. Overall, this compound's unique structural features and functional groups position it as a candidate for further research in drug development and other chemical applications.
Formula:C12H13N3S
InChI:InChI=1/C12H13N3S/c1-3-7-15-11(13-14-12(15)16)10-6-4-5-9(2)8-10/h3-6,8H,1,7H2,2H3,(H,14,16)
InChI key:AGGUEVUAPLNPMU-UHFFFAOYSA-N
SMILES:C=CCn1c(c2cccc(C)c2)nnc1S
Synonyms:
  • 4-Allyl-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
  • 4H-1,2,4-Triazole-3-thiol, 5-(3-methylphenyl)-4-(2-propen-1-yl)-
Found 2 products.