5-phenyl-1-[3-(phenylcarbonylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-phenyl-1-[3-(phenylcarbonylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-benzoylsulfanylpropanoyl)-5-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(benzoylthio)-1-oxopropyl]-5-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-benzoylsulfanylpropanoyl)-5-phenylpyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(benzoylthio)propanoyl]-5-phenyl-proline Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1C2=CC=CC=C2)C(=O)CCSC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1C2=CC=CC=C2)C(=O)CCSC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H21NO4S/c23-19(13-14-27-21(26)16-9-5-2-6-10-16)22-17(11-12-18(22)20(24)25)15-7-3-1-4-8-15/h1-10,17-18H,11-14H2,(H,24,25)