tert-butyl 1-[1-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[1-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[1-(3-benzoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: 1-[[1-[3-(benzoylthio)-2-methyl-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[1-(3-benzoylsulfanyl-2-methylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-[1-[3-(benzoylthio)-2-methyl-propanoyl]prolyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)OC(C)(C)C

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)OC(C)(C)C

InChI

InChI=1S/C25H34N2O5S/c1-17(16-33-24(31)18-10-6-5-7-11-18)21(28)26-14-8-12-19(26)22(29)27-15-9-13-20(27)23(30)32-25(2,3)4/h5-7,10-11,17,19-20H,8-9,12-16H2,1-4H3