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Crystal structure of 2-acetyl-5-(3-methoxyphenyl)-3,7-dimethyl-5H-1,3-thiazolo[3,2-a]pyrimidine-6-carboxylate

In the title mol­ecule, C(20)H(22)N(2)O(4)S, the pyrimidine ring is in a flattened half-chair conformation and the 3-meth­oxyphenyl substituent is in an axial arrangement. The thia­zole ring forms a dihedral angle of 81.3 (1)° with the benzene ring. In the crystal, weak C—H⋯S inter­actions link mol­...

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Detalles Bibliográficos
Autores principales: Prasad, N. L., Krishnamurthy, M. S., Nagarajaiah, H., Begum, Noor Shahina
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257338/
https://www.ncbi.nlm.nih.gov/pubmed/25484830
http://dx.doi.org/10.1107/S1600536814023162
Descripción
Sumario:In the title mol­ecule, C(20)H(22)N(2)O(4)S, the pyrimidine ring is in a flattened half-chair conformation and the 3-meth­oxyphenyl substituent is in an axial arrangement. The thia­zole ring forms a dihedral angle of 81.3 (1)° with the benzene ring. In the crystal, weak C—H⋯S inter­actions link mol­ecules into chains along [001]. In addition, there are π–π inter­actions between inversion-related thia­zole rings with a centroid–centroid distance of 3.529 (2) Å. The ethyl group was refined as disordered over two sets of sites with an occupancy ratio of 0.52 (3):0.48 (2).