2-[(5Z)-4-oxidanylidene-5-[(3-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 2-[(5Z)-4-oxidanylidene-5-[(3-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 2-[(5Z)-5-[(3-benzyloxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 2-[(5Z)-4-oxo-5-[(3-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 2-[(5Z)-4-oxo-5-[(3-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 2-[(5Z)-5-(3-benzoxybenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C20H17NO4S2 MolecularWeight: 399.48328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C(=CC2=CC(=CC=C2)OCC3=CC=CC=C3)SC1=S

Isomeric SMILES

CC(C(=O)O)N1C(=O)/C(=C/C2=CC(=CC=C2)OCC3=CC=CC=C3)/SC1=S

InChI

InChI=1S/C20H17NO4S2/c1-13(19(23)24)21-18(22)17(27-20(21)26)11-15-8-5-9-16(10-15)25-12-14-6-3-2-4-7-14/h2-11,13H,12H2,1H3,(H,23,24)/b17-11-