N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-fluoro-benzenesulfonamide CAS Name: N-[3-[4-(1-azepanyl)phenyl]propyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-fluorobenzenesulfonamide Traditional Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-fluoro-benzenesulfonamide Formula: C21H27FN2O2S MolecularWeight: 390.514683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)CCCNS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)CCCNS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H27FN2O2S/c22-19-8-5-9-21(17-19)27(25,26)23-14-6-7-18-10-12-20(13-11-18)24-15-3-1-2-4-16-24/h5,8-13,17,23H,1-4,6-7,14-16H2