[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl] 4-phenylsulfanylpyrrolidine-2-carboxylate

Systemtic Name: [2-methyl-3-(phenylcarbonylsulfanyl)propanoyl] 4-phenylsulfanylpyrrolidine-2-carboxylate Openeye Name: (3-benzoylsulfanyl-2-methyl-propanoyl) 4-phenylsulfanylpyrrolidine-2-carboxylate CAS Name: 4-(phenylthio)-2-pyrrolidinecarboxylic acid [3-(benzoylthio)-2-methyl-1-oxopropyl] ester IUPAC Name: (3-benzoylsulfanyl-2-methylpropanoyl) 4-phenylsulfanylpyrrolidine-2-carboxylate Traditional Name: 4-(phenylthio)pyrrolidine-2-carboxylic acid [3-(benzoylthio)-2-methyl-propanoyl] ester Formula: C22H23NO4S2 MolecularWeight: 429.55232

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)OC(=O)C2CC(CN2)SC3=CC=CC=C3

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)OC(=O)C2CC(CN2)SC3=CC=CC=C3

InChI

InChI=1S/C22H23NO4S2/c1-15(14-28-22(26)16-8-4-2-5-9-16)20(24)27-21(25)19-12-18(13-23-19)29-17-10-6-3-7-11-17/h2-11,15,18-19,23H,12-14H2,1H3