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

Systemtic Name: 6-[5-[[2-(carboxymethyloxy)phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[5-[[2-(carboxymethyloxy)phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[5-[[2-(carboxymethyloxy)phenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[5-[[2-(carboxymethyloxy)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[5-[2-(carboxymethyloxy)benzylidene]-4-keto-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O)OCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O)OCC(=O)O

InChI

InChI=1S/C18H19NO6S2/c20-15(21)8-2-1-5-9-19-17(24)14(27-18(19)26)10-12-6-3-4-7-13(12)25-11-16(22)23/h3-4,6-7,10H,1-2,5,8-9,11H2,(H,20,21)(H,22,23)