S-(2-acetamidoethyl) (5S)-2,2,5-trideuterio-5-oxidanyl-octanethioate

Systemtic Name: S-(2-acetamidoethyl) (5S)-2,2,5-trideuterio-5-oxidanyl-octanethioate Openeye Name: S-(2-acetamidoethyl) (5S)-2,2,5-trideuterio-5-hydroxy-octanethioate CAS Name: (5S)-2,2,5-trideuterio-5-hydroxyoctanethioic acid S-(2-acetamidoethyl) ester IUPAC Name: S-(2-acetamidoethyl) (5S)-2,2,5-trideuterio-5-hydroxyoctanethioate Traditional Name: (5S)-2,2,5-trideuterio-5-hydroxy-octanethioic acid S-(2-acetamidoethyl) ester Formula: C12H23NO3S MolecularWeight: 264.399405

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCC(=O)SCCNC(=O)C)O

Isomeric SMILES

[2H][C@](CCC)(CCC([2H])([2H])C(=O)SCCNC(=O)C)O

InChI

InChI=1S/C12H23NO3S/c1-3-5-11(15)6-4-7-12(16)17-9-8-13-10(2)14/h11,15H,3-9H2,1-2H3,(H,13,14)/t11-/m0/s1/i7D2,11D