N-[3-[(2,4-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(2,4-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(2,4-dimethoxyanilino)-2-quinoxalinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide Formula: C22H19FN4O4S MolecularWeight: 454.474063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19FN4O4S/c1-30-15-9-12-19(20(13-15)31-2)26-21-22(25-18-6-4-3-5-17(18)24-21)27-32(28,29)16-10-7-14(23)8-11-16/h3-13H,1-2H3,(H,24,26)(H,25,27)