methyl (2S,5S)-5-(ethanoylsulfanylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,5S)-5-(ethanoylsulfanylmethyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,5S)-5-(acetylsulfanylmethyl)pyrrolidine-2-carboxylate CAS Name: (2S,5S)-5-[(acetylthio)methyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,5S)-5-(acetylsulfanylmethyl)pyrrolidine-2-carboxylate Traditional Name: (2S,5S)-5-[(acetylthio)methyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C9H15NO3S MolecularWeight: 217.2853

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCC(N1)C(=O)OC

Isomeric SMILES

CC(=O)SC[C@@H]1CC[C@H](N1)C(=O)OC

InChI

InChI=1S/C9H15NO3S/c1-6(11)14-5-7-3-4-8(10-7)9(12)13-2/h7-8,10H,3-5H2,1-2H3/t7-,8-/m0/s1