Crystal structure of methyl 3-(3-fluorophenyl)-1-methyl-1,3a,4,9b-tetrahydro-3H-thiochromeno[4,3-c]isoxazole-3a-carboxylate

Abstract

In the title compound, C19H18FNO3S, the five-membered oxazolidine ring adopts an envelope conformation with the methine C atom of the fused bond as the flap. Its mean plane is oriented at a dihedral angle of 50.38 (1)° with respect to the fluorophenyl ring. The six-membered thiopyran ring has a half-chair conformation and its mean plane is almost coplanar with the fused benzene ring, making a dihedral angle of 4.94 (10)°. The two aromatic rings are inclined to one another by 85.96 (11)°, and the mean planes of the oxazolidine and thiopyran rings are inclined to one another by 57.64 (12)°. In the crystal, molecules are linked by C—H...π interactions, forming a three-dimensional structure.

Keywords

• crystal structure
• oxazolidine
• thiopyran
• thiochromenone
• C—H...π interactions