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

Systemtic Name: 3-[(5E)-5-[(3-bromanyl-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5E)-5-[(3-bromo-4-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5E)-5-(3-bromo-4-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C13H10BrNO4S2 MolecularWeight: 388.2568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C2C(=O)N(C(=S)S2)CCC(=O)O)Br)O

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrNO4S2/c14-8-5-7(1-2-9(8)16)6-10-12(19)15(13(20)21-10)4-3-11(17)18/h1-2,5-6,16H,3-4H2,(H,17,18)/b10-6+