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

Systemtic Name: 3-[[(5E)-5-[(4-bromanyl-3-nitro-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: 3-[[(5E)-5-[(4-bromo-3-nitro-phenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 3-[[(5E)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoate IUPAC Name: 3-[[(5E)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 3-[[(5E)-5-(4-bromo-3-nitro-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoate Formula: C18H11BrN3O5S- MolecularWeight: 461.26604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])SC1=NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC(=C(C=C2)Br)[N+](=O)[O-])/SC1=NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H12BrN3O5S/c1-21-16(23)15(8-10-5-6-13(19)14(7-10)22(26)27)28-18(21)20-12-4-2-3-11(9-12)17(24)25/h2-9H,1H3,(H,24,25)/p-1/b15-8+,20-18?