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Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate

In the title compound, C(31)H(31)N(3)O(5)S, the regioselective substitution of the thio­phene is confirmed with the amine and the amide at the 2- and 5-positions, respectively. In the mol­ecule, the thio­phene ring is twisted by 12.82 (3)° with respect to the aromatic ring of the benzamido group. In...

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Autores principales: Gautier, Yohan, Maris, Thierry, Skene, W. G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6505590/
https://www.ncbi.nlm.nih.gov/pubmed/31110792
http://dx.doi.org/10.1107/S2056989019003864
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author Gautier, Yohan
Maris, Thierry
Skene, W. G.
author_facet Gautier, Yohan
Maris, Thierry
Skene, W. G.
author_sort Gautier, Yohan
collection PubMed
description In the title compound, C(31)H(31)N(3)O(5)S, the regioselective substitution of the thio­phene is confirmed with the amine and the amide at the 2- and 5-positions, respectively. In the mol­ecule, the thio­phene ring is twisted by 12.82 (3)° with respect to the aromatic ring of the benzamido group. Intra­molecular N—H⋯O hydrogen bonds are present involving the N atoms of the primary amine and the amide groups, forming S(6) ring motifs. In the crystal, centrosymmetrically related mol­ecules are linked by pairs of N—H⋯O hydrogen bonds involving the amide carbonyl O atoms and the primary amine N atoms to form dimers of R (2) (2)(16) ring motif.
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spelling pubmed-65055902019-05-20 Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate Gautier, Yohan Maris, Thierry Skene, W. G. Acta Crystallogr E Crystallogr Commun Research Communications In the title compound, C(31)H(31)N(3)O(5)S, the regioselective substitution of the thio­phene is confirmed with the amine and the amide at the 2- and 5-positions, respectively. In the mol­ecule, the thio­phene ring is twisted by 12.82 (3)° with respect to the aromatic ring of the benzamido group. Intra­molecular N—H⋯O hydrogen bonds are present involving the N atoms of the primary amine and the amide groups, forming S(6) ring motifs. In the crystal, centrosymmetrically related mol­ecules are linked by pairs of N—H⋯O hydrogen bonds involving the amide carbonyl O atoms and the primary amine N atoms to form dimers of R (2) (2)(16) ring motif. International Union of Crystallography 2019-04-09 /pmc/articles/PMC6505590/ /pubmed/31110792 http://dx.doi.org/10.1107/S2056989019003864 Text en © Gautier et al. 2019 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Gautier, Yohan
Maris, Thierry
Skene, W. G.
Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title_full Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title_fullStr Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title_full_unstemmed Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title_short Crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
title_sort crystal structure of diethyl 2-amino-5-{4-[bis­(4-methyl­phen­yl)amino]­benzamido}­thio­phene-3,4-di­carboxyl­ate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6505590/
https://www.ncbi.nlm.nih.gov/pubmed/31110792
http://dx.doi.org/10.1107/S2056989019003864
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