Fe3O4@SiO2@Methotrexate as efficient and nanomagnetic catalyst for the synthesis of 9-(aryl)thiazolo [4,5-d] [1,2,4]triazolo [1,5-a]pyrimidin-2(3H)-ones via a cooperative anomeric based oxidation: A joint experimental and computational mechanistic study

Journal of Molecular Structure(2022)

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摘要
•Fe3O4@SiO2@Methotrexate MNPs as a recyclable catalyst was synthesized.•The preparation of pyrimidin-2(3H)-ones was studied.•A cooperative anomeric based oxidation was investigated in mechanistic pathway.•Computational mechanistic study was confirmed the reaction mechanism.
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关键词
Anomeric based oxidation (ABO),9-(Aryl)thiazolo [4,5-d] [1,2,4]triazolo [1,5-a]pyrimidin-2(3h)-ones,Computational mechanistic study,Fe3O4@SiO2@Methotrexate,Magnetic nanoparticles
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