2-(2-hydroxyphenyl)-3-[2-[(3-phenyl-2-sulfanyl-propanoyl)amino]ethanoyl]-1,3-thiazolidine-5-carboxylic acid

Systemtic Name: 2-(2-hydroxyphenyl)-3-[2-[(3-phenyl-2-sulfanyl-propanoyl)amino]ethanoyl]-1,3-thiazolidine-5-carboxylic acid Openeye Name: 2-(2-hydroxyphenyl)-3-[2-[(3-phenyl-2-sulfanyl-propanoyl)amino]acetyl]thiazolidine-5-carboxylic acid CAS Name: 2-(2-hydroxyphenyl)-3-[2-[(2-mercapto-1-oxo-3-phenylpropyl)amino]-1-oxoethyl]-5-thiazolidinecarboxylic acid IUPAC Name: 2-(2-hydroxyphenyl)-3-[2-[(3-phenyl-2-sulfanylpropanoyl)amino]acetyl]-1,3-thiazolidine-5-carboxylic acid Traditional Name: 2-(2-hydroxyphenyl)-3-[2-[(2-mercapto-3-phenyl-propanoyl)amino]acetyl]thiazolidine-5-carboxylic acid Formula: C21H22N2O5S2 MolecularWeight: 446.53978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(N1C(=O)CNC(=O)C(CC2=CC=CC=C2)S)C3=CC=CC=C3O)C(=O)O

Isomeric SMILES

C1C(SC(N1C(=O)CNC(=O)C(CC2=CC=CC=C2)S)C3=CC=CC=C3O)C(=O)O

InChI

InChI=1S/C21H22N2O5S2/c24-15-9-5-4-8-14(15)20-23(12-17(30-20)21(27)28)18(25)11-22-19(26)16(29)10-13-6-2-1-3-7-13/h1-9,16-17,20,24,29H,10-12H2,(H,22,26)(H,27,28)