ethyl 2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: ethyl 2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-[[1-(3-acetylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[1-[3-(acetylthio)-2-methyl-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(3-acetylsulfanyl-2-methylpropanoyl)pyrrolidine-2-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[1-[3-(acetylthio)-2-methyl-propanoyl]prolyl]amino]-4-(methylthio)butyric acid ethyl ester Formula: C18H30N2O5S2 MolecularWeight: 418.5712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)C1CCCN1C(=O)C(C)CSC(=O)C

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)C1CCCN1C(=O)C(C)CSC(=O)C

InChI

InChI=1S/C18H30N2O5S2/c1-5-25-18(24)14(8-10-26-4)19-16(22)15-7-6-9-20(15)17(23)12(2)11-27-13(3)21/h12,14-15H,5-11H2,1-4H3,(H,19,22)