6-[5-[(8-ethoxyquinolin-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[5-[(8-ethoxyquinolin-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[5-[(8-ethoxy-2-quinolyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[5-[(8-ethoxy-2-quinolinyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[5-[(8-ethoxyquinolin-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[5-[(8-ethoxy-2-quinolyl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N=C(C=C2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O

Isomeric SMILES

CCOC1=CC=CC2=C1N=C(C=C2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O

InChI

InChI=1S/C21H22N2O4S2/c1-2-27-16-8-6-7-14-10-11-15(22-19(14)16)13-17-20(26)23(21(28)29-17)12-5-3-4-9-18(24)25/h6-8,10-11,13H,2-5,9,12H2,1H3,(H,24,25)