(2S)-1-[(2R)-2-azanyl-3-(phenylmethylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-azanyl-3-(phenylmethylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-amino-3-benzylsulfanyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-amino-1-oxo-3-(phenylmethylthio)propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-amino-3-benzylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-amino-3-(benzylthio)propanoyl]proline Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CSCC2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@H](CSCC2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C15H20N2O3S/c16-12(10-21-9-11-5-2-1-3-6-11)14(18)17-8-4-7-13(17)15(19)20/h1-3,5-6,12-13H,4,7-10,16H2,(H,19,20)/t12-,13-/m0/s1