2-[(5E)-5-[(3-bromanyl-4,5-diethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: 2-[(5E)-5-[(3-bromanyl-4,5-diethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5E)-5-[(3-bromo-4,5-diethoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[(3-bromo-4,5-diethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5E)-5-[(3-bromo-4,5-diethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-5-(3-bromo-4,5-diethoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetate Formula: C16H15BrNO5S2- MolecularWeight: 445.328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)[O-])Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC(=O)[O-])Br)OCC

InChI

InChI=1S/C16H16BrNO5S2/c1-3-22-11-6-9(5-10(17)14(11)23-4-2)7-12-15(21)18(8-13(19)20)16(24)25-12/h5-7H,3-4,8H2,1-2H3,(H,19,20)/p-1/b12-7+