Literature DB >> 34164138

Crystal structure of ethyl 2-(3-amino-5-oxo-2-tosyl-2,5-di-hydro-1H-pyrazol-1-yl)acetate.

Nadia H Metwally1, Galal H Elgemeie2, Peter G Jones3.   

Abstract

In the title compound, C14H17N3O5S, the five-membered ring is essentially planar. The substituents at the nitro-gen atoms subtend a C-N-N-S torsion angle of -95.52 (6)°. The amino group forms an intra-molecular hydrogen bond to a sulfonyl oxygen atom; two inter-molecular hydrogen bonds from the amino group, to the other S=O group and to the oxo substituent, form a layer structure parallel to the ab plane. The structure determination confirms that the title compound is N- rather than O-alkyl-ated. © Metwally et al. 2021.

Entities:  

Keywords:  crystal structure; hydrogen bond; pyrazole; tos­yl

Year:  2021        PMID: 34164138      PMCID: PMC8183440          DOI: 10.1107/S2056989021004795

Source DB:  PubMed          Journal:  Acta Crystallogr E Crystallogr Commun


  1 in total

1.  Crystal structure of 2-(2,5-di-meth-oxy-phen-yl)benzo[d]thia-zole.

Authors:  Nadia H Metwally; Galal H Elgemeie; Peter G Jones
Journal:  Acta Crystallogr E Crystallogr Commun       Date:  2022-03-31
  1 in total

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