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http://dx.doi.org/10.13160/ricns.2015.8.1.30

Synthesis and Structural Analysis of 2-Amino-4-(4-hydroxy-3-methoxyphenyl)-7,9-dimethyl-5-oxo-4, 5, 6, 7-tetrahydropyrano [2, 3-d] pyrazolo [3, 4-b] pyridine-3-carbonitrile through X-ray Crystallography  

Ganapathy, Jagadeesan (Department of Physics, Presidency College)
Jayarajan, R. (Department of Chemistry, Pondicherry University)
Vasuki, G. (Department of Chemistry, Pondicherry University)
Sanmargam, Aravindhan (Department of Physics, Presidency College)
Publication Information
Journal of Integrative Natural Science / v.8, no.1, 2015 , pp. 30-39 More about this Journal
Abstract
The crystal structure of the potential active 2-amino-4-(4-hydroxy-3-methoxyphenyl)-7, 9-dimethyl-5-oxo-4, 5, 6, 7-tetrahydropyrano [2, 3-d] pyrazolo [3, 4-b] pyridine-3-carbonitrile ($C_{21}H_{22}N_5O_6S$) has been determined from single crystal X-ray diffraction data. In the title compound crystallizes in the monoclinic space group P-1 with unit cell dimension a=8.1201(9)${\AA}$, b=12.2684(4)${\AA}$ and c=12.387(2)${\AA}$ [${\alpha}=69.573^{\circ}$, ${\beta}=12.168^{\circ}$ and ${\gamma}=76.060^{\circ}$]. In the structure the pyrazole, pyridine and pyran are almost coplanar each other. The crystal packing is stabilized by intermolecular C-H...O and N-H... O hydrogen bond interaction.
Keywords
Pyrazole; Pyran; Single Crystal Structure; X-ray Diffraction;
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