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

Systemtic Name: ethyl 4-[[(5E)-5-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[(5E)-5-[(4-benzyloxy-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-phenylmethoxyphenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(5E)-5-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 4-[[(5E)-5-(4-benzoxy-3-bromo-5-ethoxy-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid ethyl ester Formula: C29H27BrN2O5S MolecularWeight: 595.50408

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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)OCC4=CC=CC=C4

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)OCC4=CC=CC=C4

InChI

InChI=1S/C29H27BrN2O5S/c1-4-35-24-16-20(15-23(30)26(24)37-18-19-9-7-6-8-10-19)17-25-27(33)32(3)29(38-25)31-22-13-11-21(12-14-22)28(34)36-5-2/h6-17H,4-5,18H2,1-3H3/b25-17+,31-29?