N-[4-(azepan-1-ylsulfonyl)phenyl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-fluoro-benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-fluorobenzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-fluorobenzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-fluoro-benzenesulfonamide Formula: C18H21FN2O4S2 MolecularWeight: 412.498743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H21FN2O4S2/c19-17-7-3-4-8-18(17)26(22,23)20-15-9-11-16(12-10-15)27(24,25)21-13-5-1-2-6-14-21/h3-4,7-12,20H,1-2,5-6,13-14H2