Journal of the Chemical Society Perkin Transactions 1 · 1978 · 81 citations · 0 references
Natural SciencesChemistryMedicinal ChemistryOrganic ChemistryHeterocycle SynthesisHeterocyclic ChemistryHeterocyclic CompoundsMolecular Orbital Theory[4+2] CycloadditionCycloaddition ReactionsFrontier Molecular Orbital TheoryHeterocyclic ReactivityRegioselectivity In Cycloadditions
A thermal dimerisation of the Diels–Alder type is reported for certain 3-aryl-2-cyanothioacrylamides giving rise to novel derivatives of 3,4-dihydro-2H-thiopyran. The regioselectivity and stereoselectivity of this thermal heterodiene cycloaddition reaction are rationalised in terms of frontier orbital interactions. N.m.r. and i.r. data are reported for 21 thioacrylamides in monomeric and/or dimeric form.