2-(hydroxymethyl)-6-[2-oxidanyl-3-(pyrimidin-4-ylamino)propyl]sulfanyl-oxane-3,4,5-triol

Systemtic Name: 2-(hydroxymethyl)-6-[2-oxidanyl-3-(pyrimidin-4-ylamino)propyl]sulfanyl-oxane-3,4,5-triol Openeye Name: 2-(hydroxymethyl)-6-[2-hydroxy-3-(pyrimidin-4-ylamino)propyl]sulfanyl-tetrahydropyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-[[2-hydroxy-3-(4-pyrimidinylamino)propyl]thio]oxane-3,4,5-triol IUPAC Name: 2-(hydroxymethyl)-6-[2-hydroxy-3-(pyrimidin-4-ylamino)propyl]sulfanyloxane-3,4,5-triol Traditional Name: 2-[[2-hydroxy-3-(4-pyrimidylamino)propyl]thio]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C13H21N3O6S MolecularWeight: 347.38734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CN=C1NCC(CSC2C(C(C(C(O2)CO)O)O)O)O

Isomeric SMILES

C1=CN=CN=C1NCC(CSC2C(C(C(C(O2)CO)O)O)O)O

InChI

InChI=1S/C13H21N3O6S/c17-4-8-10(19)11(20)12(21)13(22-8)23-5-7(18)3-15-9-1-2-14-6-16-9/h1-2,6-8,10-13,17-21H,3-5H2,(H,14,15,16)