1-[3-(4-chloranyl-3-sulfanyl-phenyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-(4-chloranyl-3-sulfanyl-phenyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(4-chloro-3-sulfanyl-benzoyl)sulfanylpropanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-[[(4-chloro-3-mercaptophenyl)-oxomethyl]thio]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(4-chloro-3-sulfanylbenzoyl)sulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[(4-chloro-3-mercapto-benzoyl)thio]propanoyl]proline Formula: C15H16ClNO4S2 MolecularWeight: 373.87484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCSC(=O)C2=CC(=C(C=C2)Cl)S)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCSC(=O)C2=CC(=C(C=C2)Cl)S)C(=O)O

InChI

InChI=1S/C15H16ClNO4S2/c16-10-4-3-9(8-12(10)22)15(21)23-7-5-13(18)17-6-1-2-11(17)14(19)20/h3-4,8,11,22H,1-2,5-7H2,(H,19,20)