Crystal structure, DFT studies, Hirshfeld surface and energy framework analysis of 4-(5-nitro-thiophen-2-yl)-pyrrolo [1, 2-a] quinoxaline: A potential SARS-CoV-2 main protease inhibitor

The title compound 4-(5-nitro-thiophen-2-yl)-pyrrolo[1,2-a] quinoxaline (5NO(2)TAAPP) was obtained by a straightforward catalyst-free reaction of 5-nitro-2- thiophene carboxaldehyde and 1-(2-aminophenyl) pyrrole in methanol and was structurally characterized by FT IR, UV–Vis, NMR spectroscopic techn...

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Detalles Bibliográficos
Autores principales: Divya, K.M., Savitha, D.P., Krishna, G. Anjali, Dhanya, T.M., Mohanan, P.V.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier B.V. 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9749918/
https://www.ncbi.nlm.nih.gov/pubmed/36536784
http://dx.doi.org/10.1016/j.molstruc.2021.131932

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9749918/
https://www.ncbi.nlm.nih.gov/pubmed/36536784
http://dx.doi.org/10.1016/j.molstruc.2021.131932

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