N-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(4-pyridin-4-yl-1-pyridin-1-iumyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Formula: C24H18N5O2S+ MolecularWeight: 440.49702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2[N+]4=CC=C(C=C4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2[N+]4=CC=C(C=C4)C5=CC=NC=C5

InChI

InChI=1S/C24H18N5O2S/c30-32(31,20-6-2-1-3-7-20)28-23-24(27-22-9-5-4-8-21(22)26-23)29-16-12-19(13-17-29)18-10-14-25-15-11-18/h1-17H,(H,26,28)/q+1