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Citation: YU Peng, LI Xi, HU Jund, XU Yan-Hua. Synthesis, Bioactivity and Crystal Structure Analysis of 2-(Benzo[d]isothiazol-3-yloxy)-N-(3-cyano-1-(4-fluorophenyl)-1H-pyrazol-5-yl) Acetamide[J]. Chinese Journal of Structural Chemistry, ;2014, 33(9): 1375-1382. shu

Synthesis, Bioactivity and Crystal Structure Analysis of 2-(Benzo[d]isothiazol-3-yloxy)-N-(3-cyano-1-(4-fluorophenyl)-1H-pyrazol-5-yl) Acetamide

YU Peng ^a,c ,
LI Xi ^b,c ,
HU Jund ^d ,
XU Yan-Hua ^b,c,,

1.
a College of Biotechnology and Pharmaceutical Engineering, Nanjing University of Technology, Nanjing 210009, China;
2.
b College of Environment, Nanjing University of Technology, Nanjing 210009, China;
3.
c Jiangsu Key Laboratory of Industrial Water-conservation & Emission Reduction, Nanjing 210009, ChinadPost-doctoral Research Station of Chemical Engineering and Technology, Nanjing University of Technology, Nanjing 210009, China

Corresponding author: XU Yan-Hua,
Received Date: 20 February 2014
Available Online: 25 March 2014
Fund Project: The generous financial support of this work from 2011 Key projects of Natural Science of Jiangsu province-owned colleges (No. 11KJA610001) (No. 11KJA610001) Innovation project designated for graduate students of Jiangsu province (No. CXZZ13_0452) (No. CXZZ13_0452)

A novel benzisothiazolin-3-one derivative, 2-(benzo[d]isothiazol-3-yloxy)-N-(3-cyano-1-(4-fluorophenyl)-1H-pyrazol-5-yl) acetamide (8), was synthesized from the initial compound benzo[d]isothiazol-3(2H)-one (BIT) 1 and 4-fluoroaniline 3. The structure of the target compound 8 was determined by elemental analyses, IR and 1H NMR. The single crystals of intermediate compound 6 and the target compound 8 were obtained and determined by X-ray diffraction analysis. The preliminary biological activity was also evaluated and the results showed the target compound exhibited a good anti-microbial activity.
- benzisothiazol-3(2H)-one,
- pyrazol,
- synthesis,
- bioactivity,
- crystal structure
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