2-(hydroxymethyl)-6-pyrazol-1-yloxy-thiane-3,4,5-triol

Systemtic Name: 2-(hydroxymethyl)-6-pyrazol-1-yloxy-thiane-3,4,5-triol Openeye Name: 2-(hydroxymethyl)-6-pyrazol-1-yloxy-tetrahydrothiopyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-(1-pyrazolyloxy)thiane-3,4,5-triol IUPAC Name: 2-(hydroxymethyl)-6-pyrazol-1-yloxythiane-3,4,5-triol Traditional Name: 2-methylol-6-pyrazol-1-yloxy-tetrahydrothiopyran-3,4,5-triol Formula: C9H14N2O5S MolecularWeight: 262.28286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)OC2C(C(C(C(S2)CO)O)O)O

Isomeric SMILES

C1=CN(N=C1)OC2C(C(C(C(S2)CO)O)O)O

InChI

InChI=1S/C9H14N2O5S/c12-4-5-6(13)7(14)8(15)9(17-5)16-11-3-1-2-10-11/h1-3,5-9,12-15H,4H2