1-[(2S)-2-[[(2S)-4-phenyl-2-sulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2S)-2-[[(2S)-4-phenyl-2-sulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2S)-2-[[(2S)-4-phenyl-2-sulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2S)-2-[[(2S)-2-mercapto-1-oxo-4-phenylbutyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2S)-2-[[(2S)-4-phenyl-2-sulfanylbutanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2S)-2-[[(2S)-2-mercapto-4-phenyl-butanoyl]amino]propanoyl]proline Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C(CCC2=CC=CC=C2)S

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1C(=O)O)NC(=O)[C@H](CCC2=CC=CC=C2)S

InChI

InChI=1S/C18H24N2O4S/c1-12(17(22)20-11-5-8-14(20)18(23)24)19-16(21)15(25)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,25H,5,8-11H2,1H3,(H,19,21)(H,23,24)/t12-,14?,15-/m0/s1