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

Systemtic Name: N-[3-[(4-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]-3,4-bis(chloranyl)benzenesulfonamide Openeye Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]-3,4-dichloro-benzenesulfonamide CAS Name: N-[3-[(4-butyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]-3,4-dichlorobenzenesulfonamide IUPAC Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]-3,4-dichlorobenzenesulfonamide Traditional Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]-3,4-dichloro-benzenesulfonamide Formula: C22H27Cl2N3O3S MolecularWeight: 484.43908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H27Cl2N3O3S/c1-2-3-10-26-11-5-12-27(14-13-26)22(28)17-6-4-7-18(15-17)25-31(29,30)19-8-9-20(23)21(24)16-19/h4,6-9,15-16,25H,2-3,5,10-14H2,1H3