1-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-oxo-2-[2-(phenylthio)ethylamino]ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-keto-2-[2-(phenylthio)ethylamino]ethyl]proline Formula: C15H20N2O3S MolecularWeight: 308.3959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC(=O)NCCSC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(N(C1)CC(=O)NCCSC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H20N2O3S/c18-14(11-17-9-4-7-13(17)15(19)20)16-8-10-21-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,16,18)(H,19,20)