3-[(5E)-5-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid

Systemtic Name: 3-[(5E)-5-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 3-[(5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 3-[(5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 3-[(5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 3-[(5E)-4-keto-5-[(2-keto-7-methoxy-1H-quinolin-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C21H14N2O5S2 MolecularWeight: 438.47626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)C=C3C(=O)N(C(=S)S3)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)/C=C/3\C(=O)N(C(=S)S3)C4=CC=CC(=C4)C(=O)O

InChI

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