S-(2-azanylethyl) (2R,3S,4R)-4-methyl-2-[(1S)-2-methyl-1-oxidanyl-propyl]-3-oxidanyl-5-oxidanylidene-pyrrolidine-2-carbothioate

Systemtic Name: S-(2-azanylethyl) (2R,3S,4R)-4-methyl-2-[(1S)-2-methyl-1-oxidanyl-propyl]-3-oxidanyl-5-oxidanylidene-pyrrolidine-2-carbothioate Openeye Name: S-(2-aminoethyl) (2R,3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy-2-methyl-propyl]-4-methyl-5-oxo-pyrrolidine-2-carbothioate CAS Name: (2R,3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy-2-methylpropyl]-4-methyl-5-oxo-2-pyrrolidinecarbothioic acid S-(2-aminoethyl) ester IUPAC Name: S-(2-aminoethyl) (2R,3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy-2-methylpropyl]-4-methyl-5-oxopyrrolidine-2-carbothioate Traditional Name: (2R,3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy-2-methyl-propyl]-5-keto-4-methyl-pyrrolidine-2-carbothioic acid S-(2-aminoethyl) ester Formula: C12H22N2O4S MolecularWeight: 290.37908

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(NC1=O)(C(C(C)C)O)C(=O)SCCN)O

Isomeric SMILES

C[C@@H]1[C@@H]([C@](NC1=O)([C@H](C(C)C)O)C(=O)SCCN)O

InChI

InChI=1S/C12H22N2O4S/c1-6(2)8(15)12(11(18)19-5-4-13)9(16)7(3)10(17)14-12/h6-9,15-16H,4-5,13H2,1-3H3,(H,14,17)/t7-,8+,9+,12-/m1/s1