S-ethyl (2R,3R)-5-(cyclohexylamino)-2,3-dimethyl-2-oxidanyl-5-oxidanylidene-3-sulfanyl-pentanethioate

Systemtic Name: S-ethyl (2R,3R)-5-(cyclohexylamino)-2,3-dimethyl-2-oxidanyl-5-oxidanylidene-3-sulfanyl-pentanethioate Openeye Name: S-ethyl (2R,3R)-5-(cyclohexylamino)-2-hydroxy-2,3-dimethyl-5-oxo-3-sulfanyl-pentanethioate CAS Name: (2R,3R)-5-(cyclohexylamino)-2-hydroxy-3-mercapto-2,3-dimethyl-5-oxopentanethioic acid S-ethyl ester IUPAC Name: S-ethyl (2R,3R)-5-(cyclohexylamino)-2-hydroxy-2,3-dimethyl-5-oxo-3-sulfanylpentanethioate Traditional Name: (2R,3R)-5-(cyclohexylamino)-2-hydroxy-5-keto-3-mercapto-2,3-dimethyl-pentanethioic acid S-ethyl ester Formula: C15H27NO3S2 MolecularWeight: 333.50978

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(C)(C(C)(CC(=O)NC1CCCCC1)S)O

Isomeric SMILES

CCSC(=O)[C@@](C)([C@@](C)(CC(=O)NC1CCCCC1)S)O

InChI

InChI=1S/C15H27NO3S2/c1-4-21-13(18)15(3,19)14(2,20)10-12(17)16-11-8-6-5-7-9-11/h11,19-20H,4-10H2,1-3H3,(H,16,17)/t14-,15+/m1/s1