2,5-bis(chloranyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 2,5-dichloro-N-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: 2,5-dichloro-N-[3-(4-methyl-1-piperazin-4-iumyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 2,5-dichloro-N-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 2,5-dichloro-N-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C19H20Cl2N5O2S+ MolecularWeight: 453.3654

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C19H19Cl2N5O2S/c1-25-8-10-26(11-9-25)19-18(22-15-4-2-3-5-16(15)23-19)24-29(27,28)17-12-13(20)6-7-14(17)21/h2-7,12H,8-11H2,1H3,(H,22,24)/p+1