(3S,3aR)-6-tert-butylsulfanyl-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one

Systemtic Name: (3S,3aR)-6-tert-butylsulfanyl-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one Openeye Name: (3S,3aR)-6-tert-butylsulfanyl-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one CAS Name: (3S,3aR)-6-(tert-butylthio)-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one IUPAC Name: (3S,3aR)-6-tert-butylsulfanyl-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one Traditional Name: (3S,3aR)-6-(tert-butylthio)-3-methyl-1,3,3a,4-tetrahydrocyclopenta[c]furan-5-one Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC(=O)C(=C2CO1)SC(C)(C)C

Isomeric SMILES

C[C@H]1[C@@H]2CC(=O)C(=C2CO1)SC(C)(C)C

InChI

InChI=1S/C12H18O2S/c1-7-8-5-10(13)11(9(8)6-14-7)15-12(2,3)4/h7-8H,5-6H2,1-4H3/t7-,8-/m0/s1