1-[3-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-3-[4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]propyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(5-benzal-4-keto-2-thioxo-thiazolidin-3-yl)propanoyl]isonipecotic acid Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

InChI

InChI=1S/C19H20N2O4S2/c22-16(20-9-6-14(7-10-20)18(24)25)8-11-21-17(23)15(27-19(21)26)12-13-4-2-1-3-5-13/h1-5,12,14H,6-11H2,(H,24,25)