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Quantum computational, spectroscopic investigations on N-(2-((2-chloro-4,5-dicyanophenyl)amino)ethyl)-4-methylbenzenesulfonamide by DFT/TD-DFT with different solvents, molecular docking and drug-likeness researches

MedicineNatural SciencesDifferent SolventsMolecule-based MaterialSpectra-structure CorrelationMolecular MaterialOrganic ChemistryComputational ChemistryChemistryQuantum ChemistryQuantum ComputationalMolecular DockingBiophysics