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

Systemtic Name: 1-[3-[5-[(2-methoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-[5-[(2-methoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-[5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-[5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(4-keto-5-o-anisylidene-2-thioxo-thiazolidin-3-yl)propanoyl]isonipecotic acid Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H22N2O5S2/c1-27-15-5-3-2-4-14(15)12-16-18(24)22(20(28)29-16)11-8-17(23)21-9-6-13(7-10-21)19(25)26/h2-5,12-13H,6-11H2,1H3,(H,25,26)