Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate

In the title mol­ecule, C(25)H(22)N(2)O(5)S, the atoms of the thia­zolopyrimidine ring system, with the exception of the phenyl-bearing C atom [deviation = 0.177 (2) Å], are essentially planar [r.m.s deviation = 0.100 (2) °] and the mean plane of these atoms forms dihedral angles of 89.86 (10) and 7...

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Detalles Bibliográficos
Autores principales: Jotani, Mukesh M., Baldaniya, Bharat B., Tiekink, Edward R. T.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983806/
https://www.ncbi.nlm.nih.gov/pubmed/21580607
http://dx.doi.org/10.1107/S1600536810007853
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author Jotani, Mukesh M.
Baldaniya, Bharat B.
Tiekink, Edward R. T.
author_facet Jotani, Mukesh M.
Baldaniya, Bharat B.
Tiekink, Edward R. T.
author_sort Jotani, Mukesh M.
collection PubMed
description In the title mol­ecule, C(25)H(22)N(2)O(5)S, the atoms of the thia­zolopyrimidine ring system, with the exception of the phenyl-bearing C atom [deviation = 0.177 (2) Å], are essentially planar [r.m.s deviation = 0.100 (2) °] and the mean plane of these atoms forms dihedral angles of 89.86 (10) and 7.97 (8)° with the phenyl and benzene rings, respectively. In the crystal, co-operative C—H⋯O and C—H⋯π inter­actions lead to a supra­molecular chain along the a axis. These chains are connected via π–π inter­actions [centroid–centroid = 3.7523 (13) Å].
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spelling pubmed-29838062010-12-30 Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate Jotani, Mukesh M. Baldaniya, Bharat B. Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title mol­ecule, C(25)H(22)N(2)O(5)S, the atoms of the thia­zolopyrimidine ring system, with the exception of the phenyl-bearing C atom [deviation = 0.177 (2) Å], are essentially planar [r.m.s deviation = 0.100 (2) °] and the mean plane of these atoms forms dihedral angles of 89.86 (10) and 7.97 (8)° with the phenyl and benzene rings, respectively. In the crystal, co-operative C—H⋯O and C—H⋯π inter­actions lead to a supra­molecular chain along the a axis. These chains are connected via π–π inter­actions [centroid–centroid = 3.7523 (13) Å]. International Union of Crystallography 2010-03-06 /pmc/articles/PMC2983806/ /pubmed/21580607 http://dx.doi.org/10.1107/S1600536810007853 Text en © Jotani et al. 2010 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
Jotani, Mukesh M.
Baldaniya, Bharat B.
Tiekink, Edward R. T.
Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title_full Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title_fullStr Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title_full_unstemmed Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title_short Ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
title_sort ethyl 2-(2-acetoxy­benzyl­idene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5h-1,3-thia­zolo[3,2-a]pyrimidine-6-carboxyl­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983806/
https://www.ncbi.nlm.nih.gov/pubmed/21580607
http://dx.doi.org/10.1107/S1600536810007853
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AT baldaniyabharatb ethyl22acetoxybenzylidene7methyl3oxo5phenyl23dihydro5h13thiazolo32apyrimidine6carboxylate
AT tiekinkedwardrt ethyl22acetoxybenzylidene7methyl3oxo5phenyl23dihydro5h13thiazolo32apyrimidine6carboxylate

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