(2S,3S,4R,5R)-2-(2-hydroxyethylsulfanylmethyl)-5-purin-9-yl-oxolane-3,4-diol

Systemtic Name: (2S,3S,4R,5R)-2-(2-hydroxyethylsulfanylmethyl)-5-purin-9-yl-oxolane-3,4-diol Openeye Name: (2S,3S,4R,5R)-2-(2-hydroxyethylsulfanylmethyl)-5-purin-9-yl-tetrahydrofuran-3,4-diol CAS Name: (2S,3S,4R,5R)-2-[(2-hydroxyethylthio)methyl]-5-(9-purinyl)oxolane-3,4-diol IUPAC Name: (2S,3S,4R,5R)-2-(2-hydroxyethylsulfanylmethyl)-5-purin-9-yloxolane-3,4-diol Traditional Name: (2S,3S,4R,5R)-2-[(2-hydroxyethylthio)methyl]-5-purin-9-yl-tetrahydrofuran-3,4-diol Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)CSCCO)O)O

Isomeric SMILES

C1=C2C(=NC=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSCCO)O)O

InChI

InChI=1S/C12H16N4O4S/c17-1-2-21-4-8-9(18)10(19)12(20-8)16-6-15-7-3-13-5-14-11(7)16/h3,5-6,8-10,12,17-19H,1-2,4H2/t8-,9-,10-,12-/m1/s1