1-[4-[4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[4-[4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[4-[4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-4-[4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]butyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-[4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-[4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]butanoyl]isonipecotic acid Formula: C18H20N2O4S3 MolecularWeight: 424.5574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S

InChI

InChI=1S/C18H20N2O4S3/c21-15(19-8-5-12(6-9-19)17(23)24)4-1-7-20-16(22)14(27-18(20)25)11-13-3-2-10-26-13/h2-3,10-12H,1,4-9H2,(H,23,24)