methyl (2S,4S)-4-ethanoylsulfanyl-1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-4-ethanoylsulfanyl-1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-4-acetylsulfanyl-1-[(2S)-1-tert-butoxycarbonylpyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-(acetylthio)-1-[[(2S)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-4-acetylsulfanyl-1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-4-(acetylthio)-1-[(2S)-1-tert-butoxycarbonylprolyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C18H28N2O6S MolecularWeight: 400.48972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)C2CCCN2C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(=O)S[C@H]1C[C@H](N(C1)C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C18H28N2O6S/c1-11(21)27-12-9-14(16(23)25-5)20(10-12)15(22)13-7-6-8-19(13)17(24)26-18(2,3)4/h12-14H,6-10H2,1-5H3/t12-,13-,14-/m0/s1