N-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]-2,5-bis(chloranyl)benzenesulfonamide

Systemtic Name: N-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]-2,5-bis(chloranyl)benzenesulfonamide Openeye Name: N-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]-2,5-dichloro-benzenesulfonamide CAS Name: N-[3-(3-butyl-1-imidazol-3-iumyl)-2-quinoxalinyl]-2,5-dichlorobenzenesulfonamide IUPAC Name: N-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]-2,5-dichlorobenzenesulfonamide Traditional Name: N-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]-2,5-dichloro-benzenesulfonamide Formula: C21H20Cl2N5O2S+ MolecularWeight: 477.3868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

CCCC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N5O2S/c1-2-3-10-27-11-12-28(14-27)21-20(24-17-6-4-5-7-18(17)25-21)26-31(29,30)19-13-15(22)8-9-16(19)23/h4-9,11-14H,2-3,10H2,1H3,(H,24,26)/q+1