2-[[2-(acetyloxymethyl)-3-ethanoylsulfanyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[2-(acetyloxymethyl)-3-ethanoylsulfanyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(acetoxymethyl)-3-acetylsulfanyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(acetyloxymethyl)-3-(acetylthio)-1-oxopropyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(acetyloxymethyl)-3-acetylsulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(acetoxymethyl)-3-(acetylthio)propanoyl]amino]-4-(methylthio)butyric acid Formula: C13H21NO6S2 MolecularWeight: 351.43894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CSC(=O)C)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC(=O)OCC(CSC(=O)C)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C13H21NO6S2/c1-8(15)20-6-10(7-22-9(2)16)12(17)14-11(13(18)19)4-5-21-3/h10-11H,4-7H2,1-3H3,(H,14,17)(H,18,19)