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

Systemtic Name: 3-[(4Z)-4-[(5-bromanyl-2-methoxy-phenyl)methylidene]-5-oxidanylidene-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[(4Z)-4-[(5-bromo-2-methoxy-phenyl)methylene]-5-oxo-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[(4Z)-4-[(5-bromo-2-methoxyphenyl)methylidene]-5-oxo-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[(4Z)-4-[(5-bromo-2-methoxyphenyl)methylidene]-5-oxo-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[(4Z)-4-(5-bromo-2-methoxy-benzylidene)-5-keto-2-oxazolin-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C21H21BrN2O5S MolecularWeight: 493.37084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O5S/c1-4-24(5-2)30(26,27)17-8-6-7-14(12-17)20-23-18(21(25)29-20)13-15-11-16(22)9-10-19(15)28-3/h6-13H,4-5H2,1-3H3/b18-13-