N-[3-[(4-bromanyl-3-methyl-phenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-bromanyl-3-methyl-phenyl)amino]quinoxalin-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(4-bromo-3-methyl-anilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(4-bromo-3-methylanilino)-2-quinoxalinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(4-bromo-3-methylanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(4-bromo-3-methyl-anilino)quinoxalin-2-yl]-4-fluoro-benzenesulfonamide Formula: C21H16BrFN4O2S MolecularWeight: 487.344743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrFN4O2S/c1-13-12-15(8-11-17(13)22)24-20-21(26-19-5-3-2-4-18(19)25-20)27-30(28,29)16-9-6-14(23)7-10-16/h2-12H,1H3,(H,24,25)(H,26,27)