Syntheses, crystal structures and Hirshfeld surface analysis of 2-(benzylsulfanyl)-5-[4-(dimethylamino) phenyl]-1,3,4-oxadiazole and 2-[(2-chloro-6-fluorobenzyl)sulfanyl]-5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazole.

Autor: Okmanov, Rasul Ya., Ziyaev, Abdukhakim A., Abdukarimov, Azimboy Sh., Toshmurodov, Turdibek T., Kholikov, Tursunali S.
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Zdroj: Acta Crystallographica Section E: Crystallographic Communications; May2023, Vol. 79 Issue 6, p552-9, 14p
Abstrakt: The title compounds were synthesized by alkylation of 5-[(4-dimethylamino)-phenyl]-1,3,4-oxadiazole-2-thiol with benzyl chloride or 2-chloro-6-fluorobenzyl chloride in the presence of potassium carbonate. The yields of 2-(benzylsulfanyl)-5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazole, C17H17N3OS (I), and 2-[(2-chloro-6-fluorobenzyl)sulfanyl]-5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazole, C17H15ClFN3OS (II), were 96 and 92%, respectively. In the crystal structures of (I) and (II), C-H-- -- interactions are observed between neighboring molecules. Hirshfeld surface analysis indicates that H-- -H and H-- -C/C-- -H interactions make the most important contributions to the crystal packing. [ABSTRACT FROM AUTHOR]
Databáze: Complementary Index