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Ethyl 4-(4-hydroxy-phen-yl)-6-methyl-2-thioxo-1,2,3,4-tetra-hydro-pyrimidine-5-carboxyl-ate monohydrate.

ABSTRACT: In the organic mol-ecule of the title compound, C(14)H(16)N(2)O(3)S·H(2)O, the two rings are oriented at a dihedral angle of 84.31?(2)°. In the crystal structure, intra-molecular O-H?O and inter-molecular O-H?O, N-H?O, O-H?S and N-H?S hydrogen bonds are found.

SUBMITTER: Liu B

PROVIDER: S-EPMC2915317 | biostudies-literature | 2007 Dec

REPOSITORIES: biostudies-literature

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Ethyl 4-(4-hydroxy-phen-yl)-6-methyl-2-thioxo-1,2,3,4-tetra-hydro-pyrimidine-5-carboxyl-ate monohydrate.

Liu Bo B Zhang Mingjie M Cui Naijing N Zhu Jie J Cui Jin J

Acta crystallographica. Section E, Structure reports online 20071212 Pt 1

In the organic mol-ecule of the title compound, C(14)H(16)N(2)O(3)S·H(2)O, the two rings are oriented at a dihedral angle of 84.31 (2)°. In the crystal structure, intra-molecular O-H⋯O and inter-molecular O-H⋯O, N-H⋯O, O-H⋯S and N-H⋯S hydrogen bonds are found. ...[more]

PMID: 21200826

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Ethyl 4-(4-hydroxy-phen-yl)-6-methyl-2-oxo-1,2,3,4-tetra-hydro-pyrimidine-5-carboxyl-ate monohydrate.

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