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N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide
In the crystal structure of the title compound, C(21)H(14)ClN(3)OS, molecules assemble into inversion dimers via pairs of N—H⋯N hydrogen bonds involving the N—H hydrogen of the thiazine ring and the N atom of the pyridine ring. There is a close intramolecular contact [2.570 (2) Å] between the car...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414281/ https://www.ncbi.nlm.nih.gov/pubmed/22904814 http://dx.doi.org/10.1107/S1600536812029741 |
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author | Fernandes, Manuel A. Levendis, Demetrius C. Reid, David H. |
author_facet | Fernandes, Manuel A. Levendis, Demetrius C. Reid, David H. |
author_sort | Fernandes, Manuel A. |
collection | PubMed |
description | In the crystal structure of the title compound, C(21)H(14)ClN(3)OS, molecules assemble into inversion dimers via pairs of N—H⋯N hydrogen bonds involving the N—H hydrogen of the thiazine ring and the N atom of the pyridine ring. There is a close intramolecular contact [2.570 (2) Å] between the carbonyl O atom of the benzamide and the S atom of the puckered thiazine ring. The title compound can exist in two tautomeric forms, viz. amino or imino. The observed structure is compatible with the imino form on the basis of observed residual electron density and the two C—N bond lengths of 1.308 (2) and 1.353 (2) Å. |
format | Online Article Text |
id | pubmed-3414281 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-34142812012-08-17 N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide Fernandes, Manuel A. Levendis, Demetrius C. Reid, David H. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title compound, C(21)H(14)ClN(3)OS, molecules assemble into inversion dimers via pairs of N—H⋯N hydrogen bonds involving the N—H hydrogen of the thiazine ring and the N atom of the pyridine ring. There is a close intramolecular contact [2.570 (2) Å] between the carbonyl O atom of the benzamide and the S atom of the puckered thiazine ring. The title compound can exist in two tautomeric forms, viz. amino or imino. The observed structure is compatible with the imino form on the basis of observed residual electron density and the two C—N bond lengths of 1.308 (2) and 1.353 (2) Å. International Union of Crystallography 2012-07-07 /pmc/articles/PMC3414281/ /pubmed/22904814 http://dx.doi.org/10.1107/S1600536812029741 Text en © Fernandes et al. 2012 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 Fernandes, Manuel A. Levendis, Demetrius C. Reid, David H. N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title |
N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title_full |
N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title_fullStr |
N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title_full_unstemmed |
N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title_short |
N-[(2Z,4Z)-4-Benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
title_sort | n-[(2z,4z)-4-benzylidene-6-chloro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-ylidene]benzamide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414281/ https://www.ncbi.nlm.nih.gov/pubmed/22904814 http://dx.doi.org/10.1107/S1600536812029741 |
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