N-[2-[4-(azepan-1-yl)phenyl]ethyl]-3-chloranyl-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-3-chloranyl-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-3-chloro-4-fluoro-benzenesulfonamide CAS Name: N-[2-[4-(1-azepanyl)phenyl]ethyl]-3-chloro-4-fluorobenzenesulfonamide IUPAC Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-3-chloro-4-fluorobenzenesulfonamide Traditional Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-3-chloro-4-fluoro-benzenesulfonamide Formula: C20H24ClFN2O2S MolecularWeight: 410.933163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H24ClFN2O2S/c21-19-15-18(9-10-20(19)22)27(25,26)23-12-11-16-5-7-17(8-6-16)24-13-3-1-2-4-14-24/h5-10,15,23H,1-4,11-14H2