tert-butyl (2S,4S)-2-[(1R)-3-(methylamino)-1-oxidanyl-3-oxidanylidene-propyl]-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4S)-2-[(1R)-3-(methylamino)-1-oxidanyl-3-oxidanylidene-propyl]-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4S)-2-[(1R)-1-hydroxy-3-(methylamino)-3-oxo-propyl]-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[(1R)-1-hydroxy-3-(methylamino)-3-oxopropyl]-4-mercapto-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-2-[(1R)-1-hydroxy-3-(methylamino)-3-oxopropyl]-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[(1R)-1-hydroxy-3-keto-3-(methylamino)propyl]-4-mercapto-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C13H24N2O4S MolecularWeight: 304.40566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(CC(=O)NC)O)S

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H](C[C@H]1[C@@H](CC(=O)NC)O)S

InChI

InChI=1S/C13H24N2O4S/c1-13(2,3)19-12(18)15-7-8(20)5-9(15)10(16)6-11(17)14-4/h8-10,16,20H,5-7H2,1-4H3,(H,14,17)/t8-,9-,10+/m0/s1