ethyl (5Z)-2-benzamido-5-[(5-bromanyl-2,4-dimethoxy-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-2-benzamido-5-[(5-bromanyl-2,4-dimethoxy-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-benzamido-5-[(5-bromo-2,4-dimethoxy-phenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-benzamido-5-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-benzamido-5-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-benzamido-5-(5-bromo-2,4-dimethoxy-benzylidene)-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C23H20BrNO6S MolecularWeight: 518.377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2OC)OC)Br)C1=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CC(=C(C=C2OC)OC)Br)/C1=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H20BrNO6S/c1-4-31-23(28)19-20(26)18(11-14-10-15(24)17(30-3)12-16(14)29-2)32-22(19)25-21(27)13-8-6-5-7-9-13/h5-12H,4H2,1-3H3,(H,25,27)/b18-11-