3-[[(5E)-5-[(3-bromanyl-5-ethoxy-4-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: 3-[[(5E)-5-[(3-bromanyl-5-ethoxy-4-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 3-[[(5E)-5-[(3-bromo-5-ethoxy-4-oxido-phenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoate CAS Name: 3-[[(5E)-5-[(3-bromo-5-ethoxy-4-oxidophenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoate IUPAC Name: 3-[[(5E)-5-[(3-bromo-5-ethoxy-4-oxidophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 3-[[(5E)-5-(3-bromo-5-ethoxy-4-oxido-benzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoate Formula: C19H13BrN2O5S-2 MolecularWeight: 461.28592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)[O-])Br)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)[O-])Br)[O-]

InChI

InChI=1S/C19H15BrN2O5S/c1-2-27-14-7-10(6-13(20)16(14)23)8-15-17(24)22-19(28-15)21-12-5-3-4-11(9-12)18(25)26/h3-9,23H,2H2,1H3,(H,25,26)(H,21,22,24)/p-2/b15-8+