乙酰乙酰苯胺基反应产物的晶体结构和 Hirshfeld 表面分析。
Crystal Structure and Hirshfeld Surface Analysis of Acetoacetanilide Based Reaction Products.
机构信息
Faculty of Chemistry, Baku State University, Z. Khalilov str. 23, Az 1148 Baku, Azerbaijan.
Departamento de Química, Universidad de Antofagasta, Avda. Universidad de Antofagasta 02800, Campus Coloso Antofagasta-Chile, Antofagasta 1240000, Chile.
出版信息
Molecules. 2020 May 9;25(9):2235. doi: 10.3390/molecules25092235.
We report an unprecedented multicomponent reaction of acetoacetanilide with malononitrile leading to a structurally novel bicyclic product (9) in a high yield. The structure has been confirmed by X-ray crystallography and comparative Hirshfeld surface analysis of 5-cyano-2-hydroxy-2-methyl--phenyl-4-(yridine-4-yl)-6-(thiophen-2-yl)-3,4-dihydro-2-pyran-3-carboxamide , 5-cyano-2-hydroxy-2-methyl-6-oxo--phenyl-4-(thiophen-2-yl)piperidine-3-carboxamide and 2-(8-amino-7,8a-dicyano-1-imino-4a-methyl-3-oxo-2-phenyl-1,3,4,4a,5,8a-hexahydroisoquinolin-6(2)-ylidene)--phenylacetamide .
我们报道了乙酰乙酰苯胺与丙二腈的前所未有的多组分反应，以高产率得到了结构新颖的二环产物（9）。该结构已通过 X 射线晶体学和 5-氰基-2-羟基-2-甲基-4-（吡啶-4-基）-6-（噻吩-2-基）-3,4-二氢-2-吡喃-3-羧酸酰胺、5-氰基-2-羟基-2-甲基-6-氧代-4-（噻吩-2-基）哌啶-3-羧酸酰胺和 2-（8-氨基-7,8a-二氰基-1-亚氨基-4a-甲基-3-氧代-2-苯基-1,3,4,4a,5,8a-六氢异喹啉-6(2)-亚基）-2-苯基乙酰胺的比较希夫表面分析得到了证实。
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