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1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea
In the N-substituted benzoylthiourea, C(24)H(23)N(5)OS, the benzoylthiourea unit is non-planar (r.m.s. deviation = 0.126 Å). The aliphatic part of the tetrahydroquinoline fused-ring system is disordered over two positions in a 0.592 (5):0.408 (5) ratio. The pyridine and pyrrole rings are twist...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2011
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200694/ https://www.ncbi.nlm.nih.gov/pubmed/22064903 http://dx.doi.org/10.1107/S1600536811033046 |
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| author | Asiri, Abdullah M. Faidallah, Hassan M. Al-Youbi, Abdulrahman O. Alamry, Khalid A. Ng, Seik Weng |
| author_facet | Asiri, Abdullah M. Faidallah, Hassan M. Al-Youbi, Abdulrahman O. Alamry, Khalid A. Ng, Seik Weng |
| author_sort | Asiri, Abdullah M. |
| collection | PubMed |
| description | In the N-substituted benzoylthiourea, C(24)H(23)N(5)OS, the benzoylthiourea unit is non-planar (r.m.s. deviation = 0.126 Å). The aliphatic part of the tetrahydroquinoline fused-ring system is disordered over two positions in a 0.592 (5):0.408 (5) ratio. The pyridine and pyrrole rings are twisted by 55.2 (1)° in order to avoid crowding of their respective substituents. Pairs of molecules are linked by N—H⋯N hydrogen bonds, forming centrosymmetric dimers. Furthermore, an intramolecular N—H⋯O hydrogen bond stabilizes the molecular conformation. |
| format | Online Article Text |
| id | pubmed-3200694 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2011 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-32006942011-11-06 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea Asiri, Abdullah M. Faidallah, Hassan M. Al-Youbi, Abdulrahman O. Alamry, Khalid A. Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the N-substituted benzoylthiourea, C(24)H(23)N(5)OS, the benzoylthiourea unit is non-planar (r.m.s. deviation = 0.126 Å). The aliphatic part of the tetrahydroquinoline fused-ring system is disordered over two positions in a 0.592 (5):0.408 (5) ratio. The pyridine and pyrrole rings are twisted by 55.2 (1)° in order to avoid crowding of their respective substituents. Pairs of molecules are linked by N—H⋯N hydrogen bonds, forming centrosymmetric dimers. Furthermore, an intramolecular N—H⋯O hydrogen bond stabilizes the molecular conformation. International Union of Crystallography 2011-08-27 /pmc/articles/PMC3200694/ /pubmed/22064903 http://dx.doi.org/10.1107/S1600536811033046 Text en © Asiri et al. 2011 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 Asiri, Abdullah M. Faidallah, Hassan M. Al-Youbi, Abdulrahman O. Alamry, Khalid A. Ng, Seik Weng 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title | 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title_full | 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title_fullStr | 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title_full_unstemmed | 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title_short | 1-Benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| title_sort | 1-benzoyl-3-[3-cyano-8-methyl-4-(1-methyl-1h-pyrrol-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thiourea |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200694/ https://www.ncbi.nlm.nih.gov/pubmed/22064903 http://dx.doi.org/10.1107/S1600536811033046 |
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