Synthesis, stereochemistry determination, pharmacological studies and quantum chemical analyses of bisthiazolidinone derivative

M Mushtaque, F Avecilla, ZB Hafeez, M Jahan… - Journal of Molecular …, 2017 - Elsevier
A new compound (3) bisthaizolidinone derivative was synthesized by Knoevenagel
condensation reaction. The structure of synthesized compound was elucidated by different
spectral techniques and X-ray diffraction studies. The stereochemistry of the compound (3)
was determined by 1 Hsingle bond 1 H NOESY, 1 Hsingle bond 1 H NMR COSY and single
crystal X-ray diffraction studies as (Z, Z)-configuration. The computational quantum chemical
studies of compound (3) like, IR, UV, NBO analysis were performed by DFT with Becke-3 …
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