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

Systemtic Name: 2-[[2-(acetyloxymethyl)-3-ethanoylsulfanyl-propanoyl]amino]-4-azanyl-4-oxidanylidene-butanoic acid Openeye Name: 2-[[2-(acetoxymethyl)-3-acetylsulfanyl-propanoyl]amino]-4-amino-4-oxo-butanoic acid CAS Name: 2-[[2-(acetyloxymethyl)-3-(acetylthio)-1-oxopropyl]amino]-4-amino-4-oxobutanoic acid IUPAC Name: 2-[[2-(acetyloxymethyl)-3-acetylsulfanylpropanoyl]amino]-4-amino-4-oxobutanoic acid Traditional Name: 2-[[2-(acetoxymethyl)-3-(acetylthio)propanoyl]amino]-4-amino-4-keto-butyric acid Formula: C12H18N2O7S MolecularWeight: 334.34552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O7S/c1-6(15)21-4-8(5-22-7(2)16)11(18)14-9(12(19)20)3-10(13)17/h8-9H,3-5H2,1-2H3,(H2,13,17)(H,14,18)(H,19,20)