N-(3-morpholin-4-ium-4-ylpropyl)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-(2-thienylmethyl)-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-(2-thenyl)-3-(trifluoromethyl)benzenesulfonamide Formula: C19H24F3N2O3S2+ MolecularWeight: 449.53067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN(CC2=CC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCC[NH+]1CCCN(CC2=CC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H23F3N2O3S2/c20-19(21,22)16-4-1-6-18(14-16)29(25,26)24(15-17-5-2-13-28-17)8-3-7-23-9-11-27-12-10-23/h1-2,4-6,13-14H,3,7-12,15H2/p+1