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CAS 871497-64-2

:

Ethyl 4-cyclopentyl-4,5-dihydro-5-thioxo-1H-1,2,4-triazole-3-acetate

Description:
Ethyl 4-cyclopentyl-4,5-dihydro-5-thioxo-1H-1,2,4-triazole-3-acetate, identified by its CAS number 871497-64-2, is a chemical compound that belongs to the class of triazoles, which are five-membered heterocyclic compounds containing three nitrogen atoms. This substance features a thioxo group, indicating the presence of a sulfur atom double-bonded to a carbon atom, contributing to its unique reactivity and potential biological activity. The ethyl acetate moiety suggests that it may exhibit solubility in organic solvents, making it useful in various applications, including pharmaceuticals and agrochemicals. The cyclopentyl group adds to its structural complexity, potentially influencing its interaction with biological targets. The compound may exhibit specific pharmacological properties, which could be explored in drug development or agricultural applications. As with many triazole derivatives, it may also possess antifungal or herbicidal activities, although specific biological activities would require further investigation through empirical studies. Overall, this compound represents a unique structure with potential applications in various fields of chemistry and biology.
Formula:C11H17N3O2S
InChI:InChI=1S/C11H17N3O2S/c1-2-16-10(15)7-9-12-13-11(17)14(9)8-5-3-4-6-8/h8H,2-7H2,1H3,(H,13,17)
InChI key:InChIKey=MGUWDXKJUWUMKF-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)C=1N(C(=S)NN1)C2CCCC2
Synonyms:
  • Ethyl 4-cyclopentyl-4,5-dihydro-5-thioxo-1H-1,2,4-triazole-3-acetate
  • 1H-1,2,4-Triazole-3-acetic acid, 4-cyclopentyl-4,5-dihydro-5-thioxo-, ethyl ester
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