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Crystal structure and Hirshfeld surface analysis of ethyl (3E)-5-(4-chlorophenyl)-3-{[(4-chlorophenyl) formamido]imino}-7-methyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.

Authors :
Mohamed, Shaaban K.
Mague, Joel T.
Akkurt, Mehmet
Alfayomy, Abdallah M.
Seri, Sahar M. Abou
Abdel-Raheem, Shaban A. A.
Ul-Malik, Mokhtar A. Abd
Source :
Acta Crystallographica Section E: Crystallographic Communications; Aug2022, Vol. 78 Issue 8, p846-850, 12p
Publication Year :
2022

Abstract

In the title mol­ecule, C<subscript>23</subscript>H<subscript>20</subscript>C<subscript>l2</subscript>N<subscript>4</subscript>O<subscript>3</subscript>S, the thia­zole ring is planar while the pyrimidine unit fused to it adopts a screw-boat conformation. In the crystal, thick sheets parallel to the bc plane are formed by N--H⋯N, C--H⋯N and C--H⋯O hydrogen bonds together with π-π inter­actions between the formamido carbonyl groups and the thia­zole rings. Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H⋯H (30.9%), Cl⋯H/H⋯Cl (20.7%), C⋯H/H⋯C (16.8%) and O⋯H/H⋯O (11.4%) inter­actions. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
20569890
Volume :
78
Issue :
8
Database :
Complementary Index
Journal :
Acta Crystallographica Section E: Crystallographic Communications
Publication Type :
Academic Journal
Accession number :
158581244
Full Text :
https://doi.org/10.1107/S205698902200603X