5-[2-azanyl-6-(cyclopropylamino)purin-9-yl]-4-fluoranyl-2-(hydroxymethyl)thiolan-3-ol

Systemtic Name: 5-[2-azanyl-6-(cyclopropylamino)purin-9-yl]-4-fluoranyl-2-(hydroxymethyl)thiolan-3-ol Openeye Name: 5-[2-amino-6-(cyclopropylamino)purin-9-yl]-4-fluoro-2-(hydroxymethyl)tetrahydrothiophen-3-ol CAS Name: 5-[2-amino-6-(cyclopropylamino)-9-purinyl]-4-fluoro-2-(hydroxymethyl)-3-thiolanol IUPAC Name: 5-[2-amino-6-(cyclopropylamino)purin-9-yl]-4-fluoro-2-(hydroxymethyl)thiolan-3-ol Traditional Name: 5-[2-amino-6-(cyclopropylamino)purin-9-yl]-4-fluoro-2-methylol-tetrahydrothiophen-3-ol Formula: C13H17FN6O2S MolecularWeight: 340.376483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2N=CN3C4C(C(C(S4)CO)O)F)N

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3C4C(C(C(S4)CO)O)F)N

InChI

InChI=1S/C13H17FN6O2S/c14-7-9(22)6(3-21)23-12(7)20-4-16-8-10(17-5-1-2-5)18-13(15)19-11(8)20/h4-7,9,12,21-22H,1-3H2,(H3,15,17,18,19)