N-[3-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[3-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-[4-[(2-methylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazin-4-iumyl]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-[4-[(2-methylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Formula: C23H25N6O2S2+ MolecularWeight: 481.6136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H24N6O2S2/c1-17-24-18(16-32-17)15-28-11-13-29(14-12-28)23-22(25-20-9-5-6-10-21(20)26-23)27-33(30,31)19-7-3-2-4-8-19/h2-10,16H,11-15H2,1H3,(H,25,27)/p+1