2-[[3-methyl-2-(2-methylpropyl)-4-oxidanylidene-3-sulfanyl-pentanoyl]amino]propanoic acid

Systemtic Name: 2-[[3-methyl-2-(2-methylpropyl)-4-oxidanylidene-3-sulfanyl-pentanoyl]amino]propanoic acid Openeye Name: 2-[(2-isobutyl-3-methyl-4-oxo-3-sulfanyl-pentanoyl)amino]propanoic acid CAS Name: 2-[[3-mercapto-3-methyl-2-(2-methylpropyl)-1,4-dioxopentyl]amino]propanoic acid IUPAC Name: 2-[[3-methyl-2-(2-methylpropyl)-4-oxo-3-sulfanylpentanoyl]amino]propanoic acid Traditional Name: 2-[(2-isobutyl-4-keto-3-mercapto-3-methyl-pentanoyl)amino]propionic acid Formula: C13H23NO4S MolecularWeight: 289.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)O)C(C)(C(=O)C)S

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C(=O)O)C(C)(C(=O)C)S

InChI

InChI=1S/C13H23NO4S/c1-7(2)6-10(13(5,19)9(4)15)11(16)14-8(3)12(17)18/h7-8,10,19H,6H2,1-5H3,(H,14,16)(H,17,18)