(2S,4S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-hydroxy-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-hydroxy-1-[(2S)-3-mercapto-2-methyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-hydroxy-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-hydroxy-1-[(2S)-3-mercapto-2-methyl-propanoyl]proline Formula: C9H15NO4S MolecularWeight: 233.2847

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(CC1C(=O)O)O

Isomeric SMILES

C[C@H](CS)C(=O)N1C[C@H](C[C@H]1C(=O)O)O

InChI

InChI=1S/C9H15NO4S/c1-5(4-15)8(12)10-3-6(11)2-7(10)9(13)14/h5-7,11,15H,2-4H2,1H3,(H,13,14)/t5-,6+,7+/m1/s1