tert-butyl 1-[4-azanyl-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[4-azanyl-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-(acetylsulfanylmethyl)-4-amino-4-oxo-butanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[(acetylthio)methyl]-4-amino-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-(acetylsulfanylmethyl)-4-amino-4-oxobutanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[(acetylthio)methyl]-4-amino-4-keto-butanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C16H26N2O5S MolecularWeight: 358.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC(=O)N)C(=O)N1CCCC1C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCC(CC(=O)N)C(=O)N1CCCC1C(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O5S/c1-10(19)24-9-11(8-13(17)20)14(21)18-7-5-6-12(18)15(22)23-16(2,3)4/h11-12H,5-9H2,1-4H3,(H2,17,20)