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

Systemtic Name: (2S)-2-[(2-methyl-3-sulfanyl-propanoyl)amino]pentanedioic acid Openeye Name: (2S)-2-[(2-methyl-3-sulfanyl-propanoyl)amino]pentanedioic acid CAS Name: (2S)-2-[(3-mercapto-2-methyl-1-oxopropyl)amino]pentanedioic acid IUPAC Name: (2S)-2-[(2-methyl-3-sulfanylpropanoyl)amino]pentanedioic acid Traditional Name: (2S)-2-[(3-mercapto-2-methyl-propanoyl)amino]glutaric acid Formula: C9H15NO5S MolecularWeight: 249.2841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO5S/c1-5(4-16)8(13)10-6(9(14)15)2-3-7(11)12/h5-6,16H,2-4H2,1H3,(H,10,13)(H,11,12)(H,14,15)/t5?,6-/m0/s1