O-[[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl] (phenylmethylsulfanyl)methanethioate

Systemtic Name: O-[[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl] (phenylmethylsulfanyl)methanethioate Openeye Name: O-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methyl] benzylsulfanylmethanethioate CAS Name: (phenylmethylthio)methanethioic acid O-[(3,4,5-trihydroxy-6-methoxy-2-oxanyl)methyl] ester IUPAC Name: O-[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)methyl] benzylsulfanylmethanethioate Traditional Name: (benzylthio)methanethioic acid O-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methyl] ester Formula: C15H20O6S2 MolecularWeight: 360.4457

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)COC(=S)SCC2=CC=CC=C2)O)O)O

Isomeric SMILES

COC1C(C(C(C(O1)COC(=S)SCC2=CC=CC=C2)O)O)O

InChI

InChI=1S/C15H20O6S2/c1-19-14-13(18)12(17)11(16)10(21-14)7-20-15(22)23-8-9-5-3-2-4-6-9/h2-6,10-14,16-18H,7-8H2,1H3