3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one

In the title compound, C(18)H(15)N(5)O(2)S, a weak intra­molecular C—H⋯S hydrogen bond results in a small dihedral angle of 3.71 (9)° between the methyl­phenyl and triazole rings, which, in turn, form dihedral angles of 80.09 (8) and 77.32 (8)°, respectively, with the benzoxazolone mean plane. In th...

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Autores principales: Aydın, Abdullah, Hekimoğlu, Nuray, Akkurt, Mehmet, Önkol, Tijen, Çiçekli, Şölen Urlu, Büyükgüngör, Orhan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569233/
https://www.ncbi.nlm.nih.gov/pubmed/23424456
http://dx.doi.org/10.1107/S1600536812051458
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author Aydın, Abdullah
Hekimoğlu, Nuray
Akkurt, Mehmet
Önkol, Tijen
Çiçekli, Şölen Urlu
Büyükgüngör, Orhan
author_facet Aydın, Abdullah
Hekimoğlu, Nuray
Akkurt, Mehmet
Önkol, Tijen
Çiçekli, Şölen Urlu
Büyükgüngör, Orhan
author_sort Aydın, Abdullah
collection PubMed
description In the title compound, C(18)H(15)N(5)O(2)S, a weak intra­molecular C—H⋯S hydrogen bond results in a small dihedral angle of 3.71 (9)° between the methyl­phenyl and triazole rings, which, in turn, form dihedral angles of 80.09 (8) and 77.32 (8)°, respectively, with the benzoxazolone mean plane. In the crystal, N—H⋯O hydrogen bonds link mol­ecules into chains along [001], and weak C—H⋯N hydrogen bonds and π–π inter­actions between the five- and six-membered rings [centroid–centroid distances = 3.5074 (11) and 3.616 (1) Å] consolidate the crystal packing.
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spelling pubmed-35692332013-02-19 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one Aydın, Abdullah Hekimoğlu, Nuray Akkurt, Mehmet Önkol, Tijen Çiçekli, Şölen Urlu Büyükgüngör, Orhan Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(18)H(15)N(5)O(2)S, a weak intra­molecular C—H⋯S hydrogen bond results in a small dihedral angle of 3.71 (9)° between the methyl­phenyl and triazole rings, which, in turn, form dihedral angles of 80.09 (8) and 77.32 (8)°, respectively, with the benzoxazolone mean plane. In the crystal, N—H⋯O hydrogen bonds link mol­ecules into chains along [001], and weak C—H⋯N hydrogen bonds and π–π inter­actions between the five- and six-membered rings [centroid–centroid distances = 3.5074 (11) and 3.616 (1) Å] consolidate the crystal packing. International Union of Crystallography 2013-01-04 /pmc/articles/PMC3569233/ /pubmed/23424456 http://dx.doi.org/10.1107/S1600536812051458 Text en © Aydın et al. 2013 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
Aydın, Abdullah
Hekimoğlu, Nuray
Akkurt, Mehmet
Önkol, Tijen
Çiçekli, Şölen Urlu
Büyükgüngör, Orhan
3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title_full 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title_fullStr 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title_full_unstemmed 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title_short 3-({4-[(2-Methyl­benzyl­idene)amino]-5-sulfanyl­idene-1H-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3H)-one
title_sort 3-({4-[(2-methyl­benzyl­idene)amino]-5-sulfanyl­idene-1h-1,2,4-triazol-3-yl}meth­yl)-1,3-benzoxazol-2(3h)-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569233/
https://www.ncbi.nlm.nih.gov/pubmed/23424456
http://dx.doi.org/10.1107/S1600536812051458
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