4-[(3,5-dimethoxyphenyl)amino]-N-(oxan-4-ylmethyl)-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-[(3,5-dimethoxyphenyl)amino]-N-(oxan-4-ylmethyl)-2-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-(3,5-dimethoxyanilino)-N-(tetrahydropyran-4-ylmethyl)-2-(trifluoromethyl)benzenesulfonamide CAS Name: 4-(3,5-dimethoxyanilino)-N-(4-oxanylmethyl)-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-(3,5-dimethoxyanilino)-N-(oxan-4-ylmethyl)-2-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-(3,5-dimethoxyanilino)-N-(tetrahydropyran-4-ylmethyl)-2-(trifluoromethyl)benzenesulfonamide Formula: C21H25F3N2O5S MolecularWeight: 474.49381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=CC(=C(C=C2)S(=O)(=O)NCC3CCOCC3)C(F)(F)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=CC(=C(C=C2)S(=O)(=O)NCC3CCOCC3)C(F)(F)F)OC

InChI

InChI=1S/C21H25F3N2O5S/c1-29-17-9-16(10-18(12-17)30-2)26-15-3-4-20(19(11-15)21(22,23)24)32(27,28)25-13-14-5-7-31-8-6-14/h3-4,9-12,14,25-26H,5-8,13H2,1-2H3