1-[3-(phenylcarbamoylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-(phenylcarbamoylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(phenylcarbamoylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-[[anilino(oxo)methyl]thio]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(phenylcarbamoylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(phenylcarbamoylthio)propanoyl]proline Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCSC(=O)NC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCSC(=O)NC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H18N2O4S/c18-13(17-9-4-7-12(17)14(19)20)8-10-22-15(21)16-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,21)(H,19,20)