tert-butyl (2S)-2-(3-ethoxy-2-methyl-1-methylsulfanyl-3-oxidanylidene-propyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-(3-ethoxy-2-methyl-1-methylsulfanyl-3-oxidanylidene-propyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-(3-ethoxy-2-methyl-1-methylsulfanyl-3-oxo-propyl)pyrrolidine-1-carboxylate CAS Name: (2S)-2-[3-ethoxy-2-methyl-1-(methylthio)-3-oxopropyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(3-ethoxy-2-methyl-1-methylsulfanyl-3-oxopropyl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[3-ethoxy-3-keto-2-methyl-1-(methylthio)propyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H29NO4S MolecularWeight: 331.47076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(C1CCCN1C(=O)OC(C)(C)C)SC

Isomeric SMILES

CCOC(=O)C(C)C([C@@H]1CCCN1C(=O)OC(C)(C)C)SC

InChI

InChI=1S/C16H29NO4S/c1-7-20-14(18)11(2)13(22-6)12-9-8-10-17(12)15(19)21-16(3,4)5/h11-13H,7-10H2,1-6H3/t11?,12-,13?/m0/s1