methyl (2S)-1-ethanoyl-4-(4-methylsulfonylbutyldisulfanyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-ethanoyl-4-(4-methylsulfonylbutyldisulfanyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-acetyl-4-(4-methylsulfonylbutyldisulfanyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-acetyl-4-(4-methylsulfonylbutyldisulfanyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-acetyl-4-(4-methylsulfonylbutyldisulfanyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-acetyl-4-(4-mesylbutyldisulfanyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H23NO5S3 MolecularWeight: 369.52042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)OC)SSCCCCS(=O)(=O)C

Isomeric SMILES

CC(=O)N1CC(C[C@H]1C(=O)OC)SSCCCCS(=O)(=O)C

InChI

InChI=1S/C13H23NO5S3/c1-10(15)14-9-11(8-12(14)13(16)19-2)21-20-6-4-5-7-22(3,17)18/h11-12H,4-9H2,1-3H3/t11?,12-/m0/s1