2-[2-chloranyl-6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethyl)oxolane-3,4-diol

Systemtic Name: 2-[2-chloranyl-6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethyl)oxolane-3,4-diol Openeye Name: 2-[2-chloro-6-(tetrahydropyran-4-ylamino)purin-9-yl]-5-(trifluoromethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-chloro-6-(4-oxanylamino)-9-purinyl]-5-(trifluoromethyl)oxolane-3,4-diol IUPAC Name: 2-[2-chloro-6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethyl)oxolane-3,4-diol Traditional Name: 2-[2-chloro-6-(tetrahydropyran-4-ylamino)purin-9-yl]-5-(trifluoromethyl)tetrahydrofuran-3,4-diol Formula: C15H17ClF3N5O4 MolecularWeight: 423.77479

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=NC(=NC3=C2N=CN3C4C(C(C(O4)C(F)(F)F)O)O)Cl

Isomeric SMILES

C1COCCC1NC2=NC(=NC3=C2N=CN3C4C(C(C(O4)C(F)(F)F)O)O)Cl

InChI

InChI=1S/C15H17ClF3N5O4/c16-14-22-11(21-6-1-3-27-4-2-6)7-12(23-14)24(5-20-7)13-9(26)8(25)10(28-13)15(17,18)19/h5-6,8-10,13,25-26H,1-4H2,(H,21,22,23)