(2S)-1-[3-(1H-imidazol-5-yl)-3-sulfanyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[3-(1H-imidazol-5-yl)-3-sulfanyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[3-(1H-imidazol-5-yl)-3-sulfanyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[3-(1H-imidazol-5-yl)-3-mercapto-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[3-(1H-imidazol-5-yl)-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[3-(1H-imidazol-5-yl)-3-mercapto-propanoyl]proline Formula: C11H15N3O3S MolecularWeight: 269.3201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C2=CN=CN2)S)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CC(C2=CN=CN2)S)C(=O)O

InChI

InChI=1S/C11H15N3O3S/c15-10(4-9(18)7-5-12-6-13-7)14-3-1-2-8(14)11(16)17/h5-6,8-9,18H,1-4H2,(H,12,13)(H,16,17)/t8-,9?/m0/s1