5-[(5Z)-5-[(4-butoxy-3-methoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(5Z)-5-[(4-butoxy-3-methoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-oxidanyl-benzoic acid Openeye Name: 5-[(5Z)-5-[(4-butoxy-3-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-2-hydroxy-benzoic acid CAS Name: 5-[(5Z)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-hydroxybenzoic acid IUPAC Name: 5-[(5Z)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzoic acid Traditional Name: 5-[(5Z)-5-(4-butoxy-3-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-2-hydroxy-benzoic acid Formula: C22H21NO6S2 MolecularWeight: 459.53524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)O)C(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C3=CC(=C(C=C3)O)C(=O)O)OC

InChI

InChI=1S/C22H21NO6S2/c1-3-4-9-29-17-8-5-13(10-18(17)28-2)11-19-20(25)23(22(30)31-19)14-6-7-16(24)15(12-14)21(26)27/h5-8,10-12,24H,3-4,9H2,1-2H3,(H,26,27)/b19-11-