1-[2-[5-[(4-methoxycarbonylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[5-[(4-methoxycarbonylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[5-[(4-methoxycarbonylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[5-(4-carbomethoxybenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetyl]isonipecotic acid Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H20N2O6S2/c1-28-19(27)14-4-2-12(3-5-14)10-15-17(24)22(20(29)30-15)11-16(23)21-8-6-13(7-9-21)18(25)26/h2-5,10,13H,6-9,11H2,1H3,(H,25,26)