(2S)-4-cyclohexyl-1-(2-methyl-3-sulfanyl-propanoyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-4-cyclohexyl-1-(2-methyl-3-sulfanyl-propanoyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-4-cyclohexyl-4-hydroxy-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-4-cyclohexyl-4-hydroxy-1-(3-mercapto-2-methyl-1-oxopropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-4-cyclohexyl-4-hydroxy-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-4-cyclohexyl-4-hydroxy-1-(3-mercapto-2-methyl-propanoyl)proline Formula: C15H25NO4S MolecularWeight: 315.4283

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(CC1C(=O)O)(C2CCCCC2)O

Isomeric SMILES

CC(CS)C(=O)N1CC(C[C@H]1C(=O)O)(C2CCCCC2)O

InChI

InChI=1S/C15H25NO4S/c1-10(8-21)13(17)16-9-15(20,7-12(16)14(18)19)11-5-3-2-4-6-11/h10-12,20-21H,2-9H2,1H3,(H,18,19)/t10?,12-,15?/m0/s1