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The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde

In the title imidazo[2,1-b][1,3,4]thia­diazole derivative, C(19)H(14)ClN(3)OS, the 4-methyl­benzyl and chloro­phenyl rings are inclined to the planar imidazo[2,1-b][1,3,4]thia­diazole moiety (r.m.s. deviation = 0.012 Å) by 64.5 (1) and 3.7 (1)°, respectively. The mol­ecular structure is primarily st...

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Autores principales: Sowmya, A., Anil Kumar, G. N., Kumar, Sujeet, Karki, Subhas S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5050776/
https://www.ncbi.nlm.nih.gov/pubmed/27746941
http://dx.doi.org/10.1107/S2056989016014754
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author Sowmya, A.
Anil Kumar, G. N.
Kumar, Sujeet
Karki, Subhas S.
author_facet Sowmya, A.
Anil Kumar, G. N.
Kumar, Sujeet
Karki, Subhas S.
author_sort Sowmya, A.
collection PubMed
description In the title imidazo[2,1-b][1,3,4]thia­diazole derivative, C(19)H(14)ClN(3)OS, the 4-methyl­benzyl and chloro­phenyl rings are inclined to the planar imidazo[2,1-b][1,3,4]thia­diazole moiety (r.m.s. deviation = 0.012 Å) by 64.5 (1) and 3.7 (1)°, respectively. The mol­ecular structure is primarily stabilized by a strong intra­molecular C—H⋯O hydrogen bond, leading to the formation of a pseudo-seven-membered S(7) ring motif, and a short intra­molecular C—H⋯N contact forming an S(5) ring motif. In the crystal, mol­ecules are linked by pairs of C—H⋯S hydrogen bonds, forming inversion dimers. The dimers are linked by C—H⋯O and C—H⋯π inter­actions, forming chains propagating along [110].
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spelling pubmed-50507762016-10-14 The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde Sowmya, A. Anil Kumar, G. N. Kumar, Sujeet Karki, Subhas S. Acta Crystallogr E Crystallogr Commun Research Communications In the title imidazo[2,1-b][1,3,4]thia­diazole derivative, C(19)H(14)ClN(3)OS, the 4-methyl­benzyl and chloro­phenyl rings are inclined to the planar imidazo[2,1-b][1,3,4]thia­diazole moiety (r.m.s. deviation = 0.012 Å) by 64.5 (1) and 3.7 (1)°, respectively. The mol­ecular structure is primarily stabilized by a strong intra­molecular C—H⋯O hydrogen bond, leading to the formation of a pseudo-seven-membered S(7) ring motif, and a short intra­molecular C—H⋯N contact forming an S(5) ring motif. In the crystal, mol­ecules are linked by pairs of C—H⋯S hydrogen bonds, forming inversion dimers. The dimers are linked by C—H⋯O and C—H⋯π inter­actions, forming chains propagating along [110]. International Union of Crystallography 2016-09-23 /pmc/articles/PMC5050776/ /pubmed/27746941 http://dx.doi.org/10.1107/S2056989016014754 Text en © Sowmya et al. 2016 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 Research Communications
Sowmya, A.
Anil Kumar, G. N.
Kumar, Sujeet
Karki, Subhas S.
The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title_full The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title_fullStr The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title_full_unstemmed The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title_short The crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
title_sort crystal structure of 6-(4-chloro­phen­yl)-2-(4-methyl­benz­yl)imidazo[2,1-b][1,3,4]thia­diazole-5-carbaldehyde
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5050776/
https://www.ncbi.nlm.nih.gov/pubmed/27746941
http://dx.doi.org/10.1107/S2056989016014754
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