Synthesis and crystal structure of 2-{5-[2-(2,6-dichlorophenylamino)benzyl]-4-p-tolyl-4H-1,2,4-triazol-3-ylthio}acetate |
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Institution: | 1. Department of Studies in Chemistry, Bangalore University, Bangalore 560 001, India;2. Department of Pharmaceutical Chemistry, JSS College of Pharmacy, JSS University, Mysore 570 015, India |
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Abstract: | The compound 2-{5-2-(2,6-dichlorophenylamino)benzyl]-4-p-tolyl-4H-1,2,4-triazol-3-ylthio}acetate has been prepared and characterized by IR, 1H NMR, 13C NMR and mass spectra. The crystal and molecular structure were further confirmed using single crystal X-ray diffraction. The crystal structure has been found to be stabilized by intermolecular C–H···O interaction generating bifurcated hydrogen bonds whereas the C–H···N interactions generate chain of molecules. The intramolecular N–H···N hydrogen bond forms a ring with S(7) graph-set motif. |
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Keywords: | 1 2 4-Triazole derivative Crystal structure C–H···N C–H···O/N–H···N weak interactions |
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