Synthesis, Crystal Structure and Biological Activity of N′-tert-butyl-N-(3-methoxylbenzoyl)-N-(4-methyl-1,2,3-thiadiazole-5-formylhydrazine.

Autor: Huang, Jie, Wang, Huan, Fan, Zhi-Jin, Song, Hai-Bin, Zhao, Hui, Huang, Yun, Prokhorova, Polina, Belskaya, Nataliya, Morzherin, Yury, Bakulev, Vasiliy
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Zdroj: Journal of Chemical Crystallography; Dec2011, Vol. 41 Issue 12, p1860-1865, 6p
Abstrakt: The title compound, N′-tert-butyl-N-(3-methoxylbenzoyl)-N-(4-methyl-1,2,3-thiadiazole-5-formylhydrazine (CHNOS) was prepared from the reaction of 4-methyl-1,2,3-thiadiazole-5-carbonyl chloride with N′-tert-Butyl-3-methoxylbenzohydrazine, and its structure was characterized by Hydrogen Nuclear Magnetic Resonance, High-Resolution Mass Spectrometry, IR spectra, and single crystal X-ray diffraction. The crystal of the title compound belongs to monoclinic system, space group P 21/c with cell parameters a = 17.986(2) Å, b = 8.0180(10) Å, c = 12.0190(14) Å, α = 90°, β = 91.160(5)°, γ = 90°, V = 1732.9(4) Å, Z = 4, D = 1.335 g/cm, μ (Mo Ka) = 0.209 mm, F (000) = 736, R = 0.0367 and wR = 0.0932. X-ray diffraction analysis indicates that all rings in the title compound are non-planar. The bioassay results indicated that, the title compound had good fungicide activity against Sclerotinia sclerotiorum, certain extent of insecticidal activity against Plutella xylostella L. Graphical Abstract: [Figure not available: see fulltext.]. [ABSTRACT FROM AUTHOR]
Databáze: Complementary Index