(4-acetamidophenyl)sulfonyl-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide

Systemtic Name: (4-acetamidophenyl)sulfonyl-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide Openeye Name: (4-acetamidophenyl)sulfonyl-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide CAS Name: (4-acetamidophenyl)sulfonyl-[3-(3-butyl-1-imidazol-3-iumyl)-2-quinoxalinyl]azanide IUPAC Name: (4-acetamidophenyl)sulfonyl-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide Traditional Name: (4-acetamidophenyl)sulfonyl-[3-(3-butylimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide Formula: C23H24N6O3S MolecularWeight: 464.54006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CCCC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C23H24N6O3S/c1-3-4-13-28-14-15-29(16-28)23-22(25-20-7-5-6-8-21(20)26-23)27-33(31,32)19-11-9-18(10-12-19)24-17(2)30/h5-12,14-16H,3-4,13H2,1-2H3,(H-,24,25,27,30)