rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione

The title compound, C(18)H(18)N(4)OS, has an almost planar 1,2,4-triazole ring [r.m.s. deviation = 0.0036 (2) Å], which makes dihedral angles of 78.5 (2) and 77.6 (11)° with the two phenyl rings. An intra­molecular N—H⋯S inter­action occurs. In the crystal, mol­ecules are linked by an inter­molecula...

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Detalles Bibliográficos
Autores principales: Wang, Wei, Gao, Yan, Xiao, Zuo-bing, Yao, Hong-guo, Zhang, Jing-jing
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051463/
https://www.ncbi.nlm.nih.gov/pubmed/21523029
http://dx.doi.org/10.1107/S1600536810054255
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author Wang, Wei
Gao, Yan
Xiao, Zuo-bing
Yao, Hong-guo
Zhang, Jing-jing
author_facet Wang, Wei
Gao, Yan
Xiao, Zuo-bing
Yao, Hong-guo
Zhang, Jing-jing
author_sort Wang, Wei
collection PubMed
description The title compound, C(18)H(18)N(4)OS, has an almost planar 1,2,4-triazole ring [r.m.s. deviation = 0.0036 (2) Å], which makes dihedral angles of 78.5 (2) and 77.6 (11)° with the two phenyl rings. An intra­molecular N—H⋯S inter­action occurs. In the crystal, mol­ecules are linked by an inter­molecular three-centre N—H⋯(O,S) cyclic hydrogen-bonding inter­action.
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spelling pubmed-30514632011-04-26 rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione Wang, Wei Gao, Yan Xiao, Zuo-bing Yao, Hong-guo Zhang, Jing-jing Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(18)H(18)N(4)OS, has an almost planar 1,2,4-triazole ring [r.m.s. deviation = 0.0036 (2) Å], which makes dihedral angles of 78.5 (2) and 77.6 (11)° with the two phenyl rings. An intra­molecular N—H⋯S inter­action occurs. In the crystal, mol­ecules are linked by an inter­molecular three-centre N—H⋯(O,S) cyclic hydrogen-bonding inter­action. International Union of Crystallography 2011-01-12 /pmc/articles/PMC3051463/ /pubmed/21523029 http://dx.doi.org/10.1107/S1600536810054255 Text en © Wang 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
Wang, Wei
Gao, Yan
Xiao, Zuo-bing
Yao, Hong-guo
Zhang, Jing-jing
rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title_full rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title_fullStr rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title_full_unstemmed rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title_short rac-4-Amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1H-1,2,4-triazole-5(4H)-thione
title_sort rac-4-amino-1-(2-benzoyl-1-phenyl­eth­yl)-3-methyl-1h-1,2,4-triazole-5(4h)-thione
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051463/
https://www.ncbi.nlm.nih.gov/pubmed/21523029
http://dx.doi.org/10.1107/S1600536810054255
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