tert-butyl 1-[2-(ethanoylsulfanylmethyl)-5-ethoxy-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2-(ethanoylsulfanylmethyl)-5-ethoxy-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-(acetylsulfanylmethyl)-5-ethoxy-5-oxo-pentanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[(acetylthio)methyl]-5-ethoxy-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-(acetylsulfanylmethyl)-5-ethoxy-5-oxopentanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[(acetylthio)methyl]-5-ethoxy-5-keto-pentanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C19H31NO6S MolecularWeight: 401.51754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(CSC(=O)C)C(=O)N1CCCC1C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CCC(CSC(=O)C)C(=O)N1CCCC1C(=O)OC(C)(C)C

InChI

InChI=1S/C19H31NO6S/c1-6-25-16(22)10-9-14(12-27-13(2)21)17(23)20-11-7-8-15(20)18(24)26-19(3,4)5/h14-15H,6-12H2,1-5H3