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

Systemtic Name: methyl (2S,4S)-4-ethanoylsulfanyl-1-[(2S)-2-methylpyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-4-acetylsulfanyl-1-[(2S)-2-methylpyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-(acetylthio)-1-[[(2S)-2-methyl-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-4-acetylsulfanyl-1-[(2S)-2-methylpyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-4-(acetylthio)-1-[(2S)-2-methylprolyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)C2(CCCN2)C)C(=O)OC

Isomeric SMILES

CC(=O)S[C@H]1C[C@H](N(C1)C(=O)[C@@]2(CCCN2)C)C(=O)OC

InChI

InChI=1S/C14H22N2O4S/c1-9(17)21-10-7-11(12(18)20-3)16(8-10)13(19)14(2)5-4-6-15-14/h10-11,15H,4-8H2,1-3H3/t10-,11-,14-/m0/s1