Cargando…
2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile
In the title compound, C(22)H(20)ClN(3)S(2), the S-bound benzene rings are inclined [dihedral angles = 78.13 (10) and 36.70 (9)°] with respect to the pyrimidine ring. The methylpropyl group occupies a position normal to the pyrimidine ring [N—C—C—C torsion angle = 92.3 (2)°]. In the crystal, supra...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393322/ https://www.ncbi.nlm.nih.gov/pubmed/22807879 http://dx.doi.org/10.1107/S1600536812025810 |
_version_ | 1782237722577993728 |
---|---|
author | El-Emam, Ali A. Al-Deeb, Omar A. Al-Turkistani, Abdulghafoor A. Ng, Seik Weng Tiekink, Edward R. T. |
author_facet | El-Emam, Ali A. Al-Deeb, Omar A. Al-Turkistani, Abdulghafoor A. Ng, Seik Weng Tiekink, Edward R. T. |
author_sort | El-Emam, Ali A. |
collection | PubMed |
description | In the title compound, C(22)H(20)ClN(3)S(2), the S-bound benzene rings are inclined [dihedral angles = 78.13 (10) and 36.70 (9)°] with respect to the pyrimidine ring. The methylpropyl group occupies a position normal to the pyrimidine ring [N—C—C—C torsion angle = 92.3 (2)°]. In the crystal, supramolecular layers are formed in the bc plane, being consolidated by C—H⋯π and π—π interactions, the latter between the pyrimidine and S-bound benzene rings [inter-centroid distance = 3.7683 (12) Å]. |
format | Online Article Text |
id | pubmed-3393322 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33933222012-07-17 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile El-Emam, Ali A. Al-Deeb, Omar A. Al-Turkistani, Abdulghafoor A. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(22)H(20)ClN(3)S(2), the S-bound benzene rings are inclined [dihedral angles = 78.13 (10) and 36.70 (9)°] with respect to the pyrimidine ring. The methylpropyl group occupies a position normal to the pyrimidine ring [N—C—C—C torsion angle = 92.3 (2)°]. In the crystal, supramolecular layers are formed in the bc plane, being consolidated by C—H⋯π and π—π interactions, the latter between the pyrimidine and S-bound benzene rings [inter-centroid distance = 3.7683 (12) Å]. International Union of Crystallography 2012-06-13 /pmc/articles/PMC3393322/ /pubmed/22807879 http://dx.doi.org/10.1107/S1600536812025810 Text en © El-Emam 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 El-Emam, Ali A. Al-Deeb, Omar A. Al-Turkistani, Abdulghafoor A. Ng, Seik Weng Tiekink, Edward R. T. 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title | 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title_full | 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title_fullStr | 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title_full_unstemmed | 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title_short | 2-[(4-Chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
title_sort | 2-[(4-chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)pyrimidine-5-carbonitrile |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393322/ https://www.ncbi.nlm.nih.gov/pubmed/22807879 http://dx.doi.org/10.1107/S1600536812025810 |
work_keys_str_mv | AT elemamalia 24chlorobenzylsulfanyl42methylpropyl6phenylsulfanylpyrimidine5carbonitrile AT aldeebomara 24chlorobenzylsulfanyl42methylpropyl6phenylsulfanylpyrimidine5carbonitrile AT alturkistaniabdulghafoora 24chlorobenzylsulfanyl42methylpropyl6phenylsulfanylpyrimidine5carbonitrile AT ngseikweng 24chlorobenzylsulfanyl42methylpropyl6phenylsulfanylpyrimidine5carbonitrile AT tiekinkedwardrt 24chlorobenzylsulfanyl42methylpropyl6phenylsulfanylpyrimidine5carbonitrile |