(2S,4S)-4-fluoranyl-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-fluoranyl-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-fluoro-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-fluoro-1-(3-mercapto-1-oxopropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-fluoro-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-fluoro-1-(3-mercaptopropanoyl)proline Formula: C8H12FNO3S MolecularWeight: 221.249183

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)CCS)F

Isomeric SMILES

C1[C@@H](CN([C@@H]1C(=O)O)C(=O)CCS)F

InChI

InChI=1S/C8H12FNO3S/c9-5-3-6(8(12)13)10(4-5)7(11)1-2-14/h5-6,14H,1-4H2,(H,12,13)/t5-,6-/m0/s1