ethyl 3-[[5-[(4-bromanyl-3-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: ethyl 3-[[5-[(4-bromanyl-3-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: ethyl 3-[[5-[(4-bromo-3-nitro-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 3-[[5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 3-[[5-(4-bromo-3-nitro-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]amino]benzoic acid ethyl ester Formula: C21H18BrN3O5S MolecularWeight: 504.35372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])SC1=NC3=CC=CC(=C3)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])SC1=NC3=CC=CC(=C3)C(=O)OCC

InChI

InChI=1S/C21H18BrN3O5S/c1-3-24-19(26)18(11-13-8-9-16(22)17(10-13)25(28)29)31-21(24)23-15-7-5-6-14(12-15)20(27)30-4-2/h5-12H,3-4H2,1-2H3