3-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]benzamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C3=CC(=CC=C3)F

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H30FN3O3S/c1-26(2)22(18-9-7-11-20(24)15-18)17-25-23(28)19-10-8-12-21(16-19)31(29,30)27-13-5-3-4-6-14-27/h7-12,15-16,22H,3-6,13-14,17H2,1-2H3,(H,25,28)