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Ethyl 4-(2,4-difluorophenyl)-6-methyl-1-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
The asymmetric unit of the title compound, C(20)H(18)F(2)N(2)O(2)S, contains four independent molecules, two of which are paired into a dimer by way of two N—H⋯S hydrogen bonds. The other two independent molecules are paired into two centrosymmetric dimers via pairs of intermolecular N—H⋯S hydrog...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977677/ https://www.ncbi.nlm.nih.gov/pubmed/21584020 http://dx.doi.org/10.1107/S160053680901232X |
Sumario: | The asymmetric unit of the title compound, C(20)H(18)F(2)N(2)O(2)S, contains four independent molecules, two of which are paired into a dimer by way of two N—H⋯S hydrogen bonds. The other two independent molecules are paired into two centrosymmetric dimers via pairs of intermolecular N—H⋯S hydrogen bonds. In one molecule, the carboxylate O atoms, methylene and methyl groups attached to the benzene ring are disordered between two positions in a 0.908 (3):0.092 (3) ratio. In two of the independent molecules, the F and H atoms of the diflourophenyl ring are flip-flop disordered (i.e. by 180° about the C—C bond axis linking the ring to the rest of the molecule) in a 3:2 ratio. The crystal packing is stabilized by weak intermolecular C—H⋯O hydrogen bonds. |
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