3-azanyl-5-[6-[2-(4-fluorophenyl)ethylamino]purin-9-yl]-4-oxidanyl-oxolane-2-carboxylic acid

Systemtic Name: 3-azanyl-5-[6-[2-(4-fluorophenyl)ethylamino]purin-9-yl]-4-oxidanyl-oxolane-2-carboxylic acid Openeye Name: 3-amino-5-[6-[2-(4-fluorophenyl)ethylamino]purin-9-yl]-4-hydroxy-tetrahydrofuran-2-carboxylic acid CAS Name: 3-amino-5-[6-[2-(4-fluorophenyl)ethylamino]-9-purinyl]-4-hydroxy-2-oxolanecarboxylic acid IUPAC Name: 3-amino-5-[6-[2-(4-fluorophenyl)ethylamino]purin-9-yl]-4-hydroxyoxolane-2-carboxylic acid Traditional Name: 3-amino-5-[6-[2-(4-fluorophenyl)ethylamino]purin-9-yl]-4-hydroxy-tetrahydrofuran-2-carboxylic acid Formula: C18H19FN6O4 MolecularWeight: 402.379663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)O)N)O)F

Isomeric SMILES

C1=CC(=CC=C1CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)O)N)O)F

InChI

InChI=1S/C18H19FN6O4/c19-10-3-1-9(2-4-10)5-6-21-15-12-16(23-7-22-15)25(8-24-12)17-13(26)11(20)14(29-17)18(27)28/h1-4,7-8,11,13-14,17,26H,5-6,20H2,(H,27,28)(H,21,22,23)