4-methoxy-1-[2-(2-sulfanylpropanoylamino)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxy-1-[2-(2-sulfanylpropanoylamino)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-[2-(2-sulfanylpropanoylamino)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-mercapto-1-oxopropyl)amino]-1-oxopropyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-[2-(2-sulfanylpropanoylamino)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(2-mercaptopropanoylamino)propanoyl]-4-methoxy-proline Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(CC1C(=O)O)OC)NC(=O)C(C)S

Isomeric SMILES

CC(C(=O)N1CC(CC1C(=O)O)OC)NC(=O)C(C)S

InChI

InChI=1S/C12H20N2O5S/c1-6(13-10(15)7(2)20)11(16)14-5-8(19-3)4-9(14)12(17)18/h6-9,20H,4-5H2,1-3H3,(H,13,15)(H,17,18)