N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-bromobenzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromobenzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-benzenesulfonamide Formula: C18H21BrN2O4S2 MolecularWeight: 473.40434

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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=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O4S2/c19-15-6-5-7-18(14-15)26(22,23)20-16-8-10-17(11-9-16)27(24,25)21-12-3-1-2-4-13-21/h5-11,14,20H,1-4,12-13H2