N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate

In the title compound, C(16)H(13)ClN(2)OS·H(2)O, the dihedral angle between the mean planes of the benzothia­zole ring system and the methylphenyl ring is 79.3 (6)°. The crystal packing features inter­molecular O—H⋯N, O—H⋯O and N—H⋯O hydrogen bonds involving the water mol­ecule and weak C—H⋯O, C—H⋯C...

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Autores principales: Praveen, A. S., Jasinski, Jerry P., Golen, James A., Yathirajan, H. S., Narayana, B.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201351/
https://www.ncbi.nlm.nih.gov/pubmed/22064942
http://dx.doi.org/10.1107/S1600536811035872
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author Praveen, A. S.
Jasinski, Jerry P.
Golen, James A.
Yathirajan, H. S.
Narayana, B.
author_facet Praveen, A. S.
Jasinski, Jerry P.
Golen, James A.
Yathirajan, H. S.
Narayana, B.
author_sort Praveen, A. S.
collection PubMed
description In the title compound, C(16)H(13)ClN(2)OS·H(2)O, the dihedral angle between the mean planes of the benzothia­zole ring system and the methylphenyl ring is 79.3 (6)°. The crystal packing features inter­molecular O—H⋯N, O—H⋯O and N—H⋯O hydrogen bonds involving the water mol­ecule and weak C—H⋯O, C—H⋯Cg and π–π stacking inter­actions [centroid–centroid distances = 3.8743 (7), 3.7229 (7) and 3.7076 (8) Å].
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spelling pubmed-32013512011-11-06 N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate Praveen, A. S. Jasinski, Jerry P. Golen, James A. Yathirajan, H. S. Narayana, B. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(13)ClN(2)OS·H(2)O, the dihedral angle between the mean planes of the benzothia­zole ring system and the methylphenyl ring is 79.3 (6)°. The crystal packing features inter­molecular O—H⋯N, O—H⋯O and N—H⋯O hydrogen bonds involving the water mol­ecule and weak C—H⋯O, C—H⋯Cg and π–π stacking inter­actions [centroid–centroid distances = 3.8743 (7), 3.7229 (7) and 3.7076 (8) Å]. International Union of Crystallography 2011-09-14 /pmc/articles/PMC3201351/ /pubmed/22064942 http://dx.doi.org/10.1107/S1600536811035872 Text en © Praveen 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
Praveen, A. S.
Jasinski, Jerry P.
Golen, James A.
Yathirajan, H. S.
Narayana, B.
N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title_full N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title_fullStr N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title_full_unstemmed N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title_short N-(4-Chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
title_sort n-(4-chloro-1,3-benzothia­zol-2-yl)-2-(3-methyl­phen­yl)acetamide monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201351/
https://www.ncbi.nlm.nih.gov/pubmed/22064942
http://dx.doi.org/10.1107/S1600536811035872
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