8-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]quinoline-2-carboxylic acid

Systemtic Name: 8-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]quinoline-2-carboxylic acid Openeye Name: 8-[[3-(p-tolylsulfonylamino)quinoxalin-2-yl]amino]quinoline-2-carboxylic acid CAS Name: 8-[[3-[(4-methylphenyl)sulfonylamino]-2-quinoxalinyl]amino]-2-quinolinecarboxylic acid IUPAC Name: 8-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]quinoline-2-carboxylic acid Traditional Name: 8-[[3-(tosylamino)quinoxalin-2-yl]amino]quinaldic acid Formula: C25H19N5O4S MolecularWeight: 485.51446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=CC5=C4N=C(C=C5)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=CC5=C4N=C(C=C5)C(=O)O

InChI

InChI=1S/C25H19N5O4S/c1-15-9-12-17(13-10-15)35(33,34)30-24-23(27-18-6-2-3-7-19(18)28-24)29-20-8-4-5-16-11-14-21(25(31)32)26-22(16)20/h2-14H,1H3,(H,27,29)(H,28,30)(H,31,32)