3-[(4Z)-4-[(3-bromanyl-4-fluoranyl-phenyl)methylidene]-5-oxidanylidene-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[(4Z)-4-[(3-bromanyl-4-fluoranyl-phenyl)methylidene]-5-oxidanylidene-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[(4Z)-4-[(3-bromo-4-fluoro-phenyl)methylene]-5-oxo-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[(4Z)-4-[(3-bromo-4-fluorophenyl)methylidene]-5-oxo-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[(4Z)-4-[(3-bromo-4-fluorophenyl)methylidene]-5-oxo-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[(4Z)-4-(3-bromo-4-fluoro-benzylidene)-5-keto-2-oxazolin-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C20H18BrFN2O4S MolecularWeight: 481.335323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NC(=CC3=CC(=C(C=C3)F)Br)C(=O)O2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=N/C(=C\C3=CC(=C(C=C3)F)Br)/C(=O)O2

InChI

InChI=1S/C20H18BrFN2O4S/c1-3-24(4-2)29(26,27)15-7-5-6-14(12-15)19-23-18(20(25)28-19)11-13-8-9-17(22)16(21)10-13/h5-12H,3-4H2,1-2H3/b18-11-