2-[(5E)-5-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5E)-5-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5E)-5-[(3-bromo-5-ethoxy-4-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5E)-5-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5E)-5-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5E)-5-(3-bromo-5-ethoxy-4-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C14H12BrNO5S2 MolecularWeight: 418.28278

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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)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC(=O)O)Br)O

InChI

InChI=1S/C14H12BrNO5S2/c1-2-21-9-4-7(3-8(15)12(9)19)5-10-13(20)16(6-11(17)18)14(22)23-10/h3-5,19H,2,6H2,1H3,(H,17,18)/b10-5+