2-(2-methylpropanoyl)-1-(phenylcarbonylsulfanyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(2-methylpropanoyl)-1-(phenylcarbonylsulfanyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoylsulfanyl-2-(2-methylpropanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 1-(benzoylthio)-2-(2-methyl-1-oxopropyl)-4-(phenylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoylsulfanyl-2-(2-methylpropanoyl)-4-phenylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: 1-(benzoylthio)-2-isobutyryl-4-(phenylthio)proline Formula: C22H23NO4S2 MolecularWeight: 429.55232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1(CC(CN1SC(=O)C2=CC=CC=C2)SC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C(=O)C1(CC(CN1SC(=O)C2=CC=CC=C2)SC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H23NO4S2/c1-15(2)19(24)22(21(26)27)13-18(28-17-11-7-4-8-12-17)14-23(22)29-20(25)16-9-5-3-6-10-16/h3-12,15,18H,13-14H2,1-2H3,(H,26,27)