3-(azepan-1-ylcarbonyl)-N-[1-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-[1-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[1-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-[1-(4-fluorophenyl)ethyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-[1-(4-fluorophenyl)ethyl]-4-methoxybenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-[1-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide Formula: C22H27FN2O4S MolecularWeight: 434.524183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)F)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H27FN2O4S/c1-16(17-7-9-18(23)10-8-17)24-30(27,28)19-11-12-21(29-2)20(15-19)22(26)25-13-5-3-4-6-14-25/h7-12,15-16,24H,3-6,13-14H2,1-2H3