4-[[(5Z)-5-[(2-bromanyl-5-ethoxy-4-methoxy-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-5-[(2-bromanyl-5-ethoxy-4-methoxy-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[(5Z)-5-[(2-bromo-5-ethoxy-4-methoxy-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[(5Z)-5-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[(5Z)-5-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[(5Z)-5-(2-bromo-5-ethoxy-4-methoxy-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]amino]benzoic acid Formula: C22H21BrN2O5S MolecularWeight: 505.38154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2Br)OC)OCC)SC1=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCN1C(=O)/C(=C/C2=CC(=C(C=C2Br)OC)OCC)/SC1=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H21BrN2O5S/c1-4-25-20(26)19(11-14-10-18(30-5-2)17(29-3)12-16(14)23)31-22(25)24-15-8-6-13(7-9-15)21(27)28/h6-12H,4-5H2,1-3H3,(H,27,28)/b19-11-,24-22?