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N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide
In the title compound, C(24)H(27)BrN(4)O(4)S(2), the molecule is twisted at the sulfonyl S atom with a C—S(O(2))—N(H)—C torsion angle of 62.6 (3)°. The benzene rings bridged by the sulfonamide group are tilted to each other by a dihedral angle of 60.6 (1)°. The dihedral angle between the sulfur-bri...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3515169/ https://www.ncbi.nlm.nih.gov/pubmed/23284396 http://dx.doi.org/10.1107/S1600536812040792 |
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author | Kumar, Mohan Mallesha, L. Sridhar, M. A. Kapoor, Kamini Gupta, Vivek K. Kant, Rajni |
author_facet | Kumar, Mohan Mallesha, L. Sridhar, M. A. Kapoor, Kamini Gupta, Vivek K. Kant, Rajni |
author_sort | Kumar, Mohan |
collection | PubMed |
description | In the title compound, C(24)H(27)BrN(4)O(4)S(2), the molecule is twisted at the sulfonyl S atom with a C—S(O(2))—N(H)—C torsion angle of 62.6 (3)°. The benzene rings bridged by the sulfonamide group are tilted to each other by a dihedral angle of 60.6 (1)°. The dihedral angle between the sulfur-bridged pyrimidine and benzene rings is 62.7 (1)°. The morpholine ring adopts a chair conformation. The molecular conformation is stabilized by a weak intramolecular π–π stacking interaction between the pyrimidine and the 2,4,6-trimethylbenzene rings [centroid–centroid distance = 3.793 (2) Å]. In the crystal, molecules are linked by N—H⋯O hydrogen bonds into a chain along the b axis. |
format | Online Article Text |
id | pubmed-3515169 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35151692013-01-02 N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide Kumar, Mohan Mallesha, L. Sridhar, M. A. Kapoor, Kamini Gupta, Vivek K. Kant, Rajni Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(24)H(27)BrN(4)O(4)S(2), the molecule is twisted at the sulfonyl S atom with a C—S(O(2))—N(H)—C torsion angle of 62.6 (3)°. The benzene rings bridged by the sulfonamide group are tilted to each other by a dihedral angle of 60.6 (1)°. The dihedral angle between the sulfur-bridged pyrimidine and benzene rings is 62.7 (1)°. The morpholine ring adopts a chair conformation. The molecular conformation is stabilized by a weak intramolecular π–π stacking interaction between the pyrimidine and the 2,4,6-trimethylbenzene rings [centroid–centroid distance = 3.793 (2) Å]. In the crystal, molecules are linked by N—H⋯O hydrogen bonds into a chain along the b axis. International Union of Crystallography 2012-10-03 /pmc/articles/PMC3515169/ /pubmed/23284396 http://dx.doi.org/10.1107/S1600536812040792 Text en © Kumar et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers Kumar, Mohan Mallesha, L. Sridhar, M. A. Kapoor, Kamini Gupta, Vivek K. Kant, Rajni N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title |
N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title_full |
N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title_fullStr |
N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title_full_unstemmed |
N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title_short |
N-[2-(5-Bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
title_sort | n-[2-(5-bromo-2-morpholin-4-ylpyrimidin-4-ylsulfanyl)-4-methoxyphenyl]-2,4,6-trimethylbenzenesulfonamide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3515169/ https://www.ncbi.nlm.nih.gov/pubmed/23284396 http://dx.doi.org/10.1107/S1600536812040792 |
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