2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one

In the title compound, C(19)H(19)BrN(2)O(2)S, the central thieno­pyrim­idine ring system is essentially planar, with a maximum displacement of 0.068 (3) Å. The attached cyclo­hexene ring adopts a half-chair conformation. The molecular conformation and crystal packing are stabilized by three intra­mo...

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Detalles Bibliográficos
Autores principales: Wang, Hong-Mei, Chen, Li-Li, Hu, Ting, Zeng, Xiao-Hua
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960130/
https://www.ncbi.nlm.nih.gov/pubmed/21581373
http://dx.doi.org/10.1107/S160053680803732X
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author Wang, Hong-Mei
Chen, Li-Li
Hu, Ting
Zeng, Xiao-Hua
author_facet Wang, Hong-Mei
Chen, Li-Li
Hu, Ting
Zeng, Xiao-Hua
author_sort Wang, Hong-Mei
collection PubMed
description In the title compound, C(19)H(19)BrN(2)O(2)S, the central thieno­pyrim­idine ring system is essentially planar, with a maximum displacement of 0.068 (3) Å. The attached cyclo­hexene ring adopts a half-chair conformation. The molecular conformation and crystal packing are stabilized by three intra­molecular C—H⋯O hydrogen bonds and two C—H⋯π inter­actions.
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spelling pubmed-29601302010-12-30 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one Wang, Hong-Mei Chen, Li-Li Hu, Ting Zeng, Xiao-Hua Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(19)H(19)BrN(2)O(2)S, the central thieno­pyrim­idine ring system is essentially planar, with a maximum displacement of 0.068 (3) Å. The attached cyclo­hexene ring adopts a half-chair conformation. The molecular conformation and crystal packing are stabilized by three intra­molecular C—H⋯O hydrogen bonds and two C—H⋯π inter­actions. International Union of Crystallography 2008-11-22 /pmc/articles/PMC2960130/ /pubmed/21581373 http://dx.doi.org/10.1107/S160053680803732X Text en © Wang et al. 2008 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
Wang, Hong-Mei
Chen, Li-Li
Hu, Ting
Zeng, Xiao-Hua
2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title_full 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title_fullStr 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title_full_unstemmed 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title_short 2-(4-Bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one
title_sort 2-(4-bromo­phen­oxy)-3-isopropyl-5,6,7,8-tetra­hydro-1-benzothieno[2,3-d]pyrimidin-4(3h)-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960130/
https://www.ncbi.nlm.nih.gov/pubmed/21581373
http://dx.doi.org/10.1107/S160053680803732X
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