2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-3-[methyl(propan-2-ylsulfonyl)amino]propanoic acid

Systemtic Name: 2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-3-[methyl(propan-2-ylsulfonyl)amino]propanoic acid Openeye Name: 2-(3-acetylsulfanyl-2-methyl-propanoyl)oxy-3-[isopropylsulfonyl(methyl)amino]propanoic acid CAS Name: 2-[3-(acetylthio)-2-methyl-1-oxopropoxy]-3-[methyl(propan-2-ylsulfonyl)amino]propanoic acid IUPAC Name: 2-(3-acetylsulfanyl-2-methylpropanoyl)oxy-3-[methyl(propan-2-ylsulfonyl)amino]propanoic acid Traditional Name: 2-[3-(acetylthio)-2-methyl-propanoyl]oxy-3-[isopropylsulfonyl(methyl)amino]propionic acid Formula: C13H23NO7S2 MolecularWeight: 369.45422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(C)CC(C(=O)O)OC(=O)C(C)CSC(=O)C

Isomeric SMILES

CC(C)S(=O)(=O)N(C)CC(C(=O)O)OC(=O)C(C)CSC(=O)C

InChI

InChI=1S/C13H23NO7S2/c1-8(2)23(19,20)14(5)6-11(12(16)17)21-13(18)9(3)7-22-10(4)15/h8-9,11H,6-7H2,1-5H3,(H,16,17)