3-[[4-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Formula: C20H17NO4S2 MolecularWeight: 399.48328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)SC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)SC1=S

InChI

InChI=1S/C20H17NO4S2/c1-2-21-18(22)17(27-20(21)26)11-13-6-8-16(9-7-13)25-12-14-4-3-5-15(10-14)19(23)24/h3-11H,2,12H2,1H3,(H,23,24)