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Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide
The asymmetric unit of the crystal of the title compound (common name rivaroxaban), C(19)H(18)ClN(3)O(5), contains two rivaroxaban molecules with different conformations; the C—C—N—C torsion angles between the oxazolidine and thiophene rings are −171.1 (7) and −106.8 (9)° in the two independent mo...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5778484/ https://www.ncbi.nlm.nih.gov/pubmed/29416890 http://dx.doi.org/10.1107/S2056989017017819 |
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author | Shen, Jie Tang, Gu-Ping Hu, Xiu-Rong |
author_facet | Shen, Jie Tang, Gu-Ping Hu, Xiu-Rong |
author_sort | Shen, Jie |
collection | PubMed |
description | The asymmetric unit of the crystal of the title compound (common name rivaroxaban), C(19)H(18)ClN(3)O(5), contains two rivaroxaban molecules with different conformations; the C—C—N—C torsion angles between the oxazolidine and thiophene rings are −171.1 (7) and −106.8 (9)° in the two independent molecules. In the crystal, classical N—H⋯O hydrogen bonds and weak C—H⋯O hydrogen bonds link the molecules into a three-dimensional supramolecular architecture. |
format | Online Article Text |
id | pubmed-5778484 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2018 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-57784842018-02-07 Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide Shen, Jie Tang, Gu-Ping Hu, Xiu-Rong Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the crystal of the title compound (common name rivaroxaban), C(19)H(18)ClN(3)O(5), contains two rivaroxaban molecules with different conformations; the C—C—N—C torsion angles between the oxazolidine and thiophene rings are −171.1 (7) and −106.8 (9)° in the two independent molecules. In the crystal, classical N—H⋯O hydrogen bonds and weak C—H⋯O hydrogen bonds link the molecules into a three-dimensional supramolecular architecture. International Union of Crystallography 2018-01-01 /pmc/articles/PMC5778484/ /pubmed/29416890 http://dx.doi.org/10.1107/S2056989017017819 Text en © Shen et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Shen, Jie Tang, Gu-Ping Hu, Xiu-Rong Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title | Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title_full | Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title_fullStr | Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title_full_unstemmed | Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title_short | Crystal structure of (S)-5-chloro-N-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
title_sort | crystal structure of (s)-5-chloro-n-({2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5778484/ https://www.ncbi.nlm.nih.gov/pubmed/29416890 http://dx.doi.org/10.1107/S2056989017017819 |
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