New poly heterocyclic compounds based on pyrimidine-2-thiones: synthesis, evaluation of putative antiviral agents, DFT calculation, and molecular modeling
Salwa F. Mohamed, Heba S. Abd-Elghaffar, Abd El‐Galil E. Amr, Dina H. Elnaggar, Eman S. Abou‐Amra, Hanaa M. Hosny, Ashraf M. Mohamed, Dina Nadeem Abd‐Elshafy
Topics & Concepts
ChemistryHOMO/LUMOPyrimidineMolecular orbitalElectrophileCombinatorial chemistryCarbon-13 NMRComputational chemistryCytotoxicityChemical shiftIn vitroMoleculeStereochemistryOrganic chemistryPhysical chemistryBiochemistryCatalysisSynthesis and biological activitySynthesis and Characterization of Heterocyclic CompoundsQuinazolinone synthesis and applications