3,4-bis(bromanyl)-N-[3-[(2-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide

Systemtic Name: 3,4-bis(bromanyl)-N-[3-[(2-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide Openeye Name: 3,4-dibromo-N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 3,4-dibromo-N-[3-[(2-butyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 3,4-dibromo-N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dibromo-N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Formula: C22H27Br2N3O3S MolecularWeight: 573.34108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CNCCCN1C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Br)Br

Isomeric SMILES

CCCCC1CNCCCN1C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Br)Br

InChI

InChI=1S/C22H27Br2N3O3S/c1-2-3-8-18-15-25-11-5-12-27(18)22(28)16-6-4-7-17(13-16)26-31(29,30)19-9-10-20(23)21(24)14-19/h4,6-7,9-10,13-14,18,25-26H,2-3,5,8,11-12,15H2,1H3