6-(6-chloranyl-2-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-ol

Systemtic Name: 6-(6-chloranyl-2-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-ol Openeye Name: 6-(6-chloro-2-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-ol CAS Name: 6-[6-chloro-2-(methylthio)-9-purinyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-ol IUPAC Name: 6-(6-chloro-2-methylsulfanylpurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-ol Traditional Name: 6-[6-chloro-2-(methylthio)purin-9-yl]-2-methylol-3,6-dihydro-2H-pyran-3-ol Formula: C12H13ClN4O3S MolecularWeight: 328.77462

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=N1)Cl)N=CN2C3C=CC(C(O3)CO)O

Isomeric SMILES

CSC1=NC2=C(C(=N1)Cl)N=CN2C3C=CC(C(O3)CO)O

InChI

InChI=1S/C12H13ClN4O3S/c1-21-12-15-10(13)9-11(16-12)17(5-14-9)8-3-2-6(19)7(4-18)20-8/h2-3,5-8,18-19H,4H2,1H3