(5-bromanylquinolin-8-yl) (4E)-4-[(4-fluorophenyl)sulfonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: (5-bromanylquinolin-8-yl) (4E)-4-[(4-fluorophenyl)sulfonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (5-bromo-8-quinolyl) (4E)-4-[(4-fluorophenyl)sulfonylhydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[(4-fluorophenyl)sulfonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid (5-bromo-8-quinolinyl) ester IUPAC Name: (5-bromoquinolin-8-yl) (4E)-4-[(4-fluorophenyl)sulfonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(4-fluorophenyl)sulfonylhydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid (5-bromo-8-quinolyl) ester Formula: C25H19BrFN3O5S MolecularWeight: 572.402863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNS(=O)(=O)C3=CC=C(C=C3)F)CCC2)C(=O)OC4=C5C(=C(C=C4)Br)C=CC=N5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NS(=O)(=O)C3=CC=C(C=C3)F)/CCC2)C(=O)OC4=C5C(=C(C=C4)Br)C=CC=N5

InChI

InChI=1S/C25H19BrFN3O5S/c1-14-22-19(29-30-36(32,33)16-9-7-15(27)8-10-16)5-2-6-20(22)34-24(14)25(31)35-21-12-11-18(26)17-4-3-13-28-23(17)21/h3-4,7-13,30H,2,5-6H2,1H3/b29-19+