(2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]pentanedioic acid

Systemtic Name: (2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]pentanedioic acid Openeye Name: (2S)-2-[(3-acetylsulfanyl-2-methyl-propanoyl)amino]pentanedioic acid CAS Name: (2S)-2-[[3-(acetylthio)-2-methyl-1-oxopropyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[(3-acetylsulfanyl-2-methylpropanoyl)amino]pentanedioic acid Traditional Name: (2S)-2-[[3-(acetylthio)-2-methyl-propanoyl]amino]glutaric acid Formula: C11H17NO6S MolecularWeight: 291.32078

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C11H17NO6S/c1-6(5-19-7(2)13)10(16)12-8(11(17)18)3-4-9(14)15/h6,8H,3-5H2,1-2H3,(H,12,16)(H,14,15)(H,17,18)/t6?,8-/m0/s1