2-(methylsulfanyloxymethyl)-5-purin-9-yl-oxolane-3,4-diol

Systemtic Name: 2-(methylsulfanyloxymethyl)-5-purin-9-yl-oxolane-3,4-diol Openeye Name: 2-(methylsulfanyloxymethyl)-5-purin-9-yl-tetrahydrofuran-3,4-diol CAS Name: methanesulfenic acid [3,4-dihydroxy-5-(9-purinyl)-2-oxolanyl]methyl ester IUPAC Name: 2-(methylsulfanyloxymethyl)-5-purin-9-yloxolane-3,4-diol Traditional Name: 2-[(methylthio)oxymethyl]-5-purin-9-yl-tetrahydrofuran-3,4-diol Formula: C11H14N4O4S MolecularWeight: 298.31826

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Descriptors Computed from Structure

Canonical SMILES:

CSOCC1C(C(C(O1)N2C=NC3=CN=CN=C32)O)O

Isomeric SMILES

CSOCC1C(C(C(O1)N2C=NC3=CN=CN=C32)O)O

InChI

InChI=1S/C11H14N4O4S/c1-20-18-3-7-8(16)9(17)11(19-7)15-5-14-6-2-12-4-13-10(6)15/h2,4-5,7-9,11,16-17H,3H2,1H3