N-[3-[[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]anilino]-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C26H22N8O6S2 MolecularWeight: 606.63288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H22N8O6S2/c1-16-14-24(28-17(2)27-16)32-41(37,38)20-12-10-18(11-13-20)29-25-26(31-23-9-4-3-8-22(23)30-25)33-42(39,40)21-7-5-6-19(15-21)34(35)36/h3-15H,1-2H3,(H,29,30)(H,31,33)(H,27,28,32)