(2S,4R)-4-(cyclopentylcarbamoyloxy)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4R)-4-(cyclopentylcarbamoyloxy)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-(cyclopentylcarbamoyloxy)pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-[(cyclopentylamino)-oxomethoxy]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-1-(3-acetylsulfanyl-2-methylpropanoyl)-4-(cyclopentylcarbamoyloxy)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-1-[3-(acetylthio)-2-methyl-propanoyl]-4-(cyclopentylcarbamoyloxy)proline Formula: C17H26N2O6S MolecularWeight: 386.46314

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)OC(=O)NC2CCCC2

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1C[C@@H](C[C@H]1C(=O)O)OC(=O)NC2CCCC2

InChI

InChI=1S/C17H26N2O6S/c1-10(9-26-11(2)20)15(21)19-8-13(7-14(19)16(22)23)25-17(24)18-12-5-3-4-6-12/h10,12-14H,3-9H2,1-2H3,(H,18,24)(H,22,23)/t10?,13-,14+/m1/s1