N-[3-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[3-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-(2-methyl-2-imidazolin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C18H18N5O2S+ MolecularWeight: 368.43282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCN1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=[N+](CCN1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H17N5O2S/c1-13-19-11-12-23(13)18-17(20-15-9-5-6-10-16(15)21-18)22-26(24,25)14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,20,22)/p+1