(2S,4S)-4-[(2-methylpropan-2-yl)oxy]-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-[(2-methylpropan-2-yl)oxy]-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-tert-butoxy-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-(3-mercapto-2-methyl-1-oxopropyl)-4-[(2-methylpropan-2-yl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-[(2-methylpropan-2-yl)oxy]-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-tert-butoxy-1-(3-mercapto-2-methyl-propanoyl)proline Formula: C13H23NO4S MolecularWeight: 289.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(CC1C(=O)O)OC(C)(C)C

Isomeric SMILES

CC(CS)C(=O)N1C[C@H](C[C@H]1C(=O)O)OC(C)(C)C

InChI

InChI=1S/C13H23NO4S/c1-8(7-19)11(15)14-6-9(18-13(2,3)4)5-10(14)12(16)17/h8-10,19H,5-7H2,1-4H3,(H,16,17)/t8?,9-,10-/m0/s1