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

Systemtic Name: N-[3-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinoxalin-2-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[3-(3-chloro-4-fluoro-anilino)quinoxalin-2-yl]-4-methoxy-benzenesulfonamide CAS Name: N-[3-(3-chloro-4-fluoroanilino)-2-quinoxalinyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[3-(3-chloro-4-fluoroanilino)quinoxalin-2-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[3-(3-chloro-4-fluoro-anilino)quinoxalin-2-yl]-4-methoxy-benzenesulfonamide Formula: C21H16ClFN4O3S MolecularWeight: 458.893143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H16ClFN4O3S/c1-30-14-7-9-15(10-8-14)31(28,29)27-21-20(24-13-6-11-17(23)16(22)12-13)25-18-4-2-3-5-19(18)26-21/h2-12H,1H3,(H,24,25)(H,26,27)