4-[(5E)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[(5E)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[(5E)-5-[(8-methoxy-2-quinolyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 2-hydroxy-4-[(5E)-5-[(8-methoxy-2-quinolinyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 2-hydroxy-4-[(5E)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 2-hydroxy-4-[(5E)-4-keto-5-[(8-methoxy-2-quinolyl)methylene]-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C21H14N2O5S2 MolecularWeight: 438.47626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC(=C(C=C4)C(=O)O)O

Isomeric SMILES

COC1=CC=CC2=C1N=C(C=C2)/C=C/3\C(=O)N(C(=S)S3)C4=CC(=C(C=C4)C(=O)O)O

InChI

InChI=1S/C21H14N2O5S2/c1-28-16-4-2-3-11-5-6-12(22-18(11)16)9-17-19(25)23(21(29)30-17)13-7-8-14(20(26)27)15(24)10-13/h2-10,24H,1H3,(H,26,27)/b17-9+