5-bromanyl-N-[3-[(3-chlorophenyl)amino]quinoxalin-2-yl]-2-ethoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[3-[(3-chlorophenyl)amino]quinoxalin-2-yl]-2-ethoxy-benzenesulfonamide Openeye Name: 5-bromo-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-ethoxy-benzenesulfonamide CAS Name: 5-bromo-N-[3-(3-chloroanilino)-2-quinoxalinyl]-2-ethoxybenzenesulfonamide IUPAC Name: 5-bromo-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-ethoxybenzenesulfonamide Traditional Name: 5-bromo-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-ethoxy-benzenesulfonamide Formula: C22H18BrClN4O3S MolecularWeight: 533.82532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H18BrClN4O3S/c1-2-31-19-11-10-14(23)12-20(19)32(29,30)28-22-21(25-16-7-5-6-15(24)13-16)26-17-8-3-4-9-18(17)27-22/h3-13H,2H2,1H3,(H,25,26)(H,27,28)