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

Systemtic Name: 4-[(5E)-5-[(3-bromanyl-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 4-[(5E)-5-[(3-bromo-4-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 4-[(5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 4-[(5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 4-[(5E)-5-(3-bromo-4-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C17H10BrNO4S2 MolecularWeight: 436.2996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C(=O)C(=CC3=CC(=C(C=C3)O)Br)SC2=S

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C(=O)/C(=C\C3=CC(=C(C=C3)O)Br)/SC2=S

InChI

InChI=1S/C17H10BrNO4S2/c18-12-7-9(1-6-13(12)20)8-14-15(21)19(17(24)25-14)11-4-2-10(3-5-11)16(22)23/h1-8,20H,(H,22,23)/b14-8+