S-ethyl (2S)-2-[(1R)-1-oxidanylprop-2-enyl]hexanethioate

Systemtic Name: S-ethyl (2S)-2-[(1R)-1-oxidanylprop-2-enyl]hexanethioate Openeye Name: S-ethyl (2S)-2-[(1R)-1-hydroxyallyl]hexanethioate CAS Name: (2S)-2-[(1R)-1-hydroxyprop-2-enyl]hexanethioic acid S-ethyl ester IUPAC Name: S-ethyl (2S)-2-[(1R)-1-hydroxyprop-2-enyl]hexanethioate Traditional Name: (2S,3R)-2-butyl-3-hydroxy-pent-4-enethioic acid S-ethyl ester Formula: C11H20O2S MolecularWeight: 216.3403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C=C)O)C(=O)SCC

Isomeric SMILES

CCCC[C@@H]([C@@H](C=C)O)C(=O)SCC

InChI

InChI=1S/C11H20O2S/c1-4-7-8-9(10(12)5-2)11(13)14-6-3/h5,9-10,12H,2,4,6-8H2,1,3H3/t9-,10+/m0/s1