tert-butyl 1-[2,3-bis(phenylcarbonylsulfanyl)propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2,3-bis(phenylcarbonylsulfanyl)propanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2,3-bis(benzoylsulfanyl)propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2,3-bis(benzoylthio)-1-oxopropyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2,3-bis(benzoylsulfanyl)propanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2,3-bis(benzoylthio)propanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C26H29NO5S2 MolecularWeight: 499.64216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1C(=O)C(CSC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1CCCN1C(=O)C(CSC(=O)C2=CC=CC=C2)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H29NO5S2/c1-26(2,3)32-23(29)20-15-10-16-27(20)22(28)21(34-25(31)19-13-8-5-9-14-19)17-33-24(30)18-11-6-4-7-12-18/h4-9,11-14,20-21H,10,15-17H2,1-3H3