O-ethyl [(3aR,7aR)-3-methyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-4-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [(3aR,7aR)-3-methyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-4-yl]sulfanylmethanethioate Openeye Name: O-ethyl [(3aR,7aR)-3-methyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-4-yl]sulfanylmethanethioate CAS Name: [[(3aR,7aR)-3-methyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-4-yl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [(3aR,7aR)-3-methyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-4-yl]sulfanylmethanethioate Traditional Name: [[(3aR,7aR)-2-keto-3-methyl-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-4-yl]thio]methanethioic acid O-ethyl ester Formula: C12H18O3S2 MolecularWeight: 274.39952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1CCCC2C1C(C(=O)O2)C

Isomeric SMILES

CCOC(=S)SC1CCC[C@@H]2[C@H]1C(C(=O)O2)C

InChI

InChI=1S/C12H18O3S2/c1-3-14-12(16)17-9-6-4-5-8-10(9)7(2)11(13)15-8/h7-10H,3-6H2,1-2H3/t7?,8-,9?,10-/m1/s1