(3S)-3-[(1S)-2-methyl-1-oxidanyl-propyl]thian-4-one

Systemtic Name: (3S)-3-[(1S)-2-methyl-1-oxidanyl-propyl]thian-4-one Openeye Name: (3S)-3-[(1S)-1-hydroxy-2-methyl-propyl]tetrahydrothiopyran-4-one CAS Name: (3S)-3-[(1S)-1-hydroxy-2-methylpropyl]-4-thianone IUPAC Name: (3S)-3-[(1S)-1-hydroxy-2-methylpropyl]thian-4-one Traditional Name: (3S)-3-[(1S)-1-hydroxy-2-methyl-propyl]tetrahydrothiopyran-4-one Formula: C9H16O2S MolecularWeight: 188.28714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1CSCCC1=O)O

Isomeric SMILES

CC(C)[C@@H]([C@@H]1CSCCC1=O)O

InChI

InChI=1S/C9H16O2S/c1-6(2)9(11)7-5-12-4-3-8(7)10/h6-7,9,11H,3-5H2,1-2H3/t7-,9+/m1/s1