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

Systemtic Name: 1-(2-acetamido-3-ethanoylsulfanyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-acetamido-3-acetylsulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[2-acetamido-3-(acetylthio)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-acetamido-3-acetylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-acetamido-3-(acetylthio)propanoyl]proline Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CC(=O)NC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C12H18N2O5S/c1-7(15)13-9(6-20-8(2)16)11(17)14-5-3-4-10(14)12(18)19/h9-10H,3-6H2,1-2H3,(H,13,15)(H,18,19)