N-[3-[(2,5-dimethylphenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(2,5-dimethylphenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(2,5-dimethylanilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(2,5-dimethylanilino)-2-quinoxalinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(2,5-dimethylanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(2,5-dimethylanilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide Formula: C22H19FN4O2S MolecularWeight: 422.475263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN4O2S/c1-14-7-8-15(2)20(13-14)26-21-22(25-19-6-4-3-5-18(19)24-21)27-30(28,29)17-11-9-16(23)10-12-17/h3-13H,1-2H3,(H,24,26)(H,25,27)