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

Systemtic Name: 2-[5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Openeye Name: 2-[5-[(8-methoxy-2-quinolyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanedioic acid CAS Name: 2-[5-[(8-methoxy-2-quinolinyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanedioic acid IUPAC Name: 2-[5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Traditional Name: 2-[4-keto-5-[(8-methoxy-2-quinolyl)methylene]-2-thioxo-thiazolidin-3-yl]succinic acid Formula: C18H14N2O6S2 MolecularWeight: 418.44356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O6S2/c1-26-12-4-2-3-9-5-6-10(19-15(9)12)7-13-16(23)20(18(27)28-13)11(17(24)25)8-14(21)22/h2-7,11H,8H2,1H3,(H,21,22)(H,24,25)