2-[6-(furan-2-ylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-(furan-2-ylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(2-furylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(2-furanylamino)-2-(3-phenoxyprop-1-ynyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(furan-2-ylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(2-furylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C23H21N5O6 MolecularWeight: 463.44274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC#CC2=NC3=C(C(=N2)NC4=CC=CO4)N=CN3C5C(C(C(O5)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC#CC2=NC3=C(C(=N2)NC4=CC=CO4)N=CN3C5C(C(C(O5)CO)O)O

InChI

InChI=1S/C23H21N5O6/c29-12-15-19(30)20(31)23(34-15)28-13-24-18-21(27-17-9-5-11-33-17)25-16(26-22(18)28)8-4-10-32-14-6-2-1-3-7-14/h1-3,5-7,9,11,13,15,19-20,23,29-31H,10,12H2,(H,25,26,27)