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

Systemtic Name: N-[3-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(5-chloro-2,4-dimethoxy-anilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(5-chloro-2,4-dimethoxyanilino)-2-quinoxalinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(5-chloro-2,4-dimethoxyanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(5-chloro-2,4-dimethoxy-anilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide Formula: C22H18ClFN4O4S MolecularWeight: 488.919123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)F)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)F)Cl)OC

InChI

InChI=1S/C22H18ClFN4O4S/c1-31-19-12-20(32-2)18(11-15(19)23)27-21-22(26-17-6-4-3-5-16(17)25-21)28-33(29,30)14-9-7-13(24)8-10-14/h3-12H,1-2H3,(H,25,27)(H,26,28)