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

Systemtic Name: ethyl 4-[[(5E)-5-[(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[(5E)-5-[(4-allyloxy-3-bromo-5-ethoxy-phenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 4-[[(5E)-5-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(5E)-5-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 4-[[(5E)-5-(4-allyloxy-3-bromo-5-ethoxy-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid ethyl ester Formula: C25H25BrN2O5S MolecularWeight: 545.4454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=NC3=CC=C(C=C3)C(=O)OCC)S2)C)Br)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrN2O5S/c1-5-12-33-22-19(26)13-16(14-20(22)31-6-2)15-21-23(29)28(4)25(34-21)27-18-10-8-17(9-11-18)24(30)32-7-3/h5,8-11,13-15H,1,6-7,12H2,2-4H3/b21-15+,27-25?