3-cyano-N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-cyano-N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-cyano-N-[3-(3,5-dimethoxyanilino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-cyano-N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]benzenesulfonamide Formula: C23H19N5O4S MolecularWeight: 461.49306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)C#N)OC

InChI

InChI=1S/C23H19N5O4S/c1-31-17-11-16(12-18(13-17)32-2)25-22-23(27-21-9-4-3-8-20(21)26-22)28-33(29,30)19-7-5-6-15(10-19)14-24/h3-13H,1-2H3,(H,25,26)(H,27,28)