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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)O)N2C(=O)C(=CC3=CC=C(C=C3)OC)SC2=S

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)O)N2C(=O)C(=CC3=CC=C(C=C3)OC)SC2=S

InChI

InChI=1S/C20H22N2O5S2/c1-12(17(23)21-9-7-14(8-10-21)19(25)26)22-18(24)16(29-20(22)28)11-13-3-5-15(27-2)6-4-13/h3-6,11-12,14H,7-10H2,1-2H3,(H,25,26)