(E)-3-[[(2S,3R)-5-ethanoyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylsulfanyl]-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-[[(2S,3R)-5-ethanoyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylsulfanyl]-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-3-[[(2S,3R)-5-acetyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylsulfanyl]-4-hydroxy-pent-3-en-2-one CAS Name: (E)-3-[[(2S,3R)-5-acetyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylthio]-4-hydroxy-3-penten-2-one IUPAC Name: (E)-3-[[(2S,3R)-5-acetyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylsulfanyl]-4-hydroxypent-3-en-2-one Traditional Name: (E)-3-[[(2S,3R)-5-acetyl-2-(4-methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-3-yl]methylthio]-4-hydroxy-pent-3-en-2-one Formula: C20H24O5S2 MolecularWeight: 408.53156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(C(O1)C2=CC=C(C=C2)OC)CSC(=C(C)O)C(=O)C)C(=O)C

Isomeric SMILES

CC1=C(S[C@H]([C@@H](O1)C2=CC=C(C=C2)OC)CS/C(=C(\C)/O)/C(=O)C)C(=O)C

InChI

InChI=1S/C20H24O5S2/c1-11(21)19(12(2)22)26-10-17-18(15-6-8-16(24-5)9-7-15)25-14(4)20(27-17)13(3)23/h6-9,17-18,21H,10H2,1-5H3/b19-11+/t17-,18-/m0/s1