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

Systemtic Name: 1-[2-[4-oxidanylidene-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[5-[(4-isopropylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-[4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[5-(4-isopropylbenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propanoyl]isonipecotic acid Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4S2/c1-13(2)16-6-4-15(5-7-16)12-18-20(26)24(22(29)30-18)14(3)19(25)23-10-8-17(9-11-23)21(27)28/h4-7,12-14,17H,8-11H2,1-3H3,(H,27,28)