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Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile
The title compound, C(11)H(9)N(5)OS(2), a 1-thiophen-2-ylmethyleneaminopyrimidine derivative, displays an essentially planar C—NH(2) group. The conformation across the N=C bond linking the pyrimidine and thienyl groups is E. The pyrimidine and thienyl ring systems subtend an inter-planar angle...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2015
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4644996/ https://www.ncbi.nlm.nih.gov/pubmed/26594500 http://dx.doi.org/10.1107/S205698901501885X |
| _version_ | 1782400738409840640 |
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| author | Elgemeie, Galal H. Salah, Ali M. Mohamed, Reham A. Jones, Peter G. |
| author_facet | Elgemeie, Galal H. Salah, Ali M. Mohamed, Reham A. Jones, Peter G. |
| author_sort | Elgemeie, Galal H. |
| collection | PubMed |
| description | The title compound, C(11)H(9)N(5)OS(2), a 1-thiophen-2-ylmethyleneaminopyrimidine derivative, displays an essentially planar C—NH(2) group. The conformation across the N=C bond linking the pyrimidine and thienyl groups is E. The pyrimidine and thienyl ring systems subtend an inter-planar angle of 42.72 (5)°. In the crystal, molecules are linked by N–H⋯N(nitrile) and N–H⋯O=C hydrogen bonds, forming chains parallel to the b axis. |
| format | Online Article Text |
| id | pubmed-4644996 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2015 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-46449962015-11-20 Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile Elgemeie, Galal H. Salah, Ali M. Mohamed, Reham A. Jones, Peter G. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, C(11)H(9)N(5)OS(2), a 1-thiophen-2-ylmethyleneaminopyrimidine derivative, displays an essentially planar C—NH(2) group. The conformation across the N=C bond linking the pyrimidine and thienyl groups is E. The pyrimidine and thienyl ring systems subtend an inter-planar angle of 42.72 (5)°. In the crystal, molecules are linked by N–H⋯N(nitrile) and N–H⋯O=C hydrogen bonds, forming chains parallel to the b axis. International Union of Crystallography 2015-10-14 /pmc/articles/PMC4644996/ /pubmed/26594500 http://dx.doi.org/10.1107/S205698901501885X Text en © Elgemeie et al. 2015 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 | Research Communications Elgemeie, Galal H. Salah, Ali M. Mohamed, Reham A. Jones, Peter G. Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title | Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title_full | Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title_fullStr | Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title_full_unstemmed | Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title_short | Crystal structure of (E)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| title_sort | crystal structure of (e)-2-amino-4-methylsulfanyl-6-oxo-1-{[(thiophen-2-yl)methylidene]amino}-1,6-dihydropyrimidine-5-carbonitrile |
| topic | Research Communications |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4644996/ https://www.ncbi.nlm.nih.gov/pubmed/26594500 http://dx.doi.org/10.1107/S205698901501885X |
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