(2S,6S)-2,6-dimethylthian-4-one

Systemtic Name: (2S,6S)-2,6-dimethylthian-4-one Openeye Name: (2S,6S)-2,6-dimethyltetrahydrothiopyran-4-one CAS Name: (2S,6S)-2,6-dimethyl-4-thianone IUPAC Name: (2S,6S)-2,6-dimethylthian-4-one Traditional Name: (2S,6S)-2,6-dimethyltetrahydrothiopyran-4-one Formula: C7H12OS MolecularWeight: 144.23458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)CC(S1)C

Isomeric SMILES

C[C@H]1CC(=O)C[C@@H](S1)C

InChI

InChI=1S/C7H12OS/c1-5-3-7(8)4-6(2)9-5/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1