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CAS 93350-66-4

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[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)sulfanyl]acetate

Description:
The chemical substance known as [(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)sulfanyl]acetate, with the CAS number 93350-66-4, is characterized by its unique structural features and functional groups. It contains a pyrazole ring, which is a five-membered ring with two adjacent nitrogen atoms, contributing to its potential biological activity. The presence of the sulfanyl group (–S–) indicates that it may exhibit thiol-like properties, which can influence its reactivity and interactions with other molecules. The acetate moiety suggests that it can participate in esterification reactions and may exhibit solubility in polar solvents. Additionally, the dimethyl and phenyl substituents on the pyrazole ring can enhance its lipophilicity and potentially affect its pharmacokinetic properties. Overall, this compound may have applications in medicinal chemistry, particularly in the development of new pharmaceuticals, due to its diverse functional groups and structural complexity. Further studies would be necessary to fully elucidate its properties and potential uses.
Formula:C13H13N2O2S
InChI:InChI=1/C13H14N2O2S/c1-9-13(18-8-12(16)17)10(2)15(14-9)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,16,17)/p-1
SMILES:Cc1c(c(C)n(c2ccccc2)n1)SCC(=O)[O-]
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