1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-2-methyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-2-methyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-2-methyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-2-methyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-2-methylpyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-2-methyl-proline Formula: C12H19NO4S MolecularWeight: 273.34856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CCCC1(C)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CCCC1(C)C(=O)O

InChI

InChI=1S/C12H19NO4S/c1-8(7-18-9(2)14)10(15)13-6-4-5-12(13,3)11(16)17/h8H,4-7H2,1-3H3,(H,16,17)