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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 |
Sumario: | 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. |
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