6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile

The title thio­uracil derivative, C(9)H(11)N(3)OS, exists in the thione form. The six atoms comprising the ring are almost coplanar [r.m.s. deviation = 0.015 Å] and the 2-methyl­propyl group lies approximately perpendicular to this plane [the N—C—C—C torsion angle is 72.88 (14)°]. Linear supra­molec...

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Detalles Bibliográficos
Autores principales: Al-Deeb, Omar A., El-Emam, Ali A., Al-Turkistani, Abdulghafoor A., Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3295462/
https://www.ncbi.nlm.nih.gov/pubmed/22412573
http://dx.doi.org/10.1107/S1600536812005119
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author Al-Deeb, Omar A.
El-Emam, Ali A.
Al-Turkistani, Abdulghafoor A.
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Al-Deeb, Omar A.
El-Emam, Ali A.
Al-Turkistani, Abdulghafoor A.
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Al-Deeb, Omar A.
collection PubMed
description The title thio­uracil derivative, C(9)H(11)N(3)OS, exists in the thione form. The six atoms comprising the ring are almost coplanar [r.m.s. deviation = 0.015 Å] and the 2-methyl­propyl group lies approximately perpendicular to this plane [the N—C—C—C torsion angle is 72.88 (14)°]. Linear supra­molecular chains along [001] sustained by N—H⋯O and N—H⋯S hydrogen bonding feature in the crystal packing.
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spelling pubmed-32954622012-03-12 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile Al-Deeb, Omar A. El-Emam, Ali A. Al-Turkistani, Abdulghafoor A. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title thio­uracil derivative, C(9)H(11)N(3)OS, exists in the thione form. The six atoms comprising the ring are almost coplanar [r.m.s. deviation = 0.015 Å] and the 2-methyl­propyl group lies approximately perpendicular to this plane [the N—C—C—C torsion angle is 72.88 (14)°]. Linear supra­molecular chains along [001] sustained by N—H⋯O and N—H⋯S hydrogen bonding feature in the crystal packing. International Union of Crystallography 2012-02-10 /pmc/articles/PMC3295462/ /pubmed/22412573 http://dx.doi.org/10.1107/S1600536812005119 Text en © Al-Deeb 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
Al-Deeb, Omar A.
El-Emam, Ali A.
Al-Turkistani, Abdulghafoor A.
Ng, Seik Weng
Tiekink, Edward R. T.
6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title_full 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title_fullStr 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title_full_unstemmed 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title_short 6-(2-Methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
title_sort 6-(2-methyl­prop­yl)-4-oxo-2-sulfanyl­idene-1,2,3,4-tetra­hydro­pyrimidine-5-carbonitrile
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3295462/
https://www.ncbi.nlm.nih.gov/pubmed/22412573
http://dx.doi.org/10.1107/S1600536812005119
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