CAS 261761-26-6: 5-[4-(tert-butyl)phenyl]-4-(4-isopropylphenyl)-4H-1,2,4-triazole-3-thiol

Description: 5-[4-(tert-butyl)phenyl]-4-(4-isopropylphenyl)-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 functional group (-SH), which contributes to its reactivity and potential applications in various chemical reactions, including as a ligand in coordination chemistry. The presence of bulky tert-butyl and isopropyl groups enhances its steric properties, potentially influencing its solubility and interaction with other molecules. The compound may exhibit interesting biological activities, making it a candidate for pharmaceutical research. Its molecular structure suggests that it could participate in hydrogen bonding due to the thiol group, which may also affect its stability and reactivity. Overall, this compound's unique structural features and functional groups make it a subject of interest in both synthetic and medicinal chemistry.

Formula: C₂₁H₂₅N₃S

InChI: InChI=1/C21H25N3S/c1-14(2)15-8-12-18(13-9-15)24-19(22-23-20(24)25)16-6-10-17(11-7-16)21(3,4)5/h6-14H,1-5H3,(H,23,25)

Synonyms:

• 5-(4-tert-butylphenyl)-4-[4-(1-methylethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

3H-1,2,4-Triazole-3-thione, 5-[4-(1,1-dimethylethyl)phenyl]-2,4-dihydro-4-[4-(1-methylethyl)phenyl]-

CAS: 261761-26-6

• Formula: C₂₁H₂₅N₃S
• Molecular weight: 351.5083

5-(4-tert-Butylphenyl)-4-(4-isopropylphenyl)-1,2,4-triazole-3-thiol

CAS: 261761-26-6

• Color and Shape: Solid
• Molecular weight: 351.51g/mol