N-[2-fluoranyl-9-[3-methyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]propanamide

Systemtic Name: N-[2-fluoranyl-9-[3-methyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]propanamide Openeye Name: N-[9-[4-benzyloxy-5-(benzyloxymethyl)-3-methyl-tetrahydrofuran-2-yl]-2-fluoro-purin-6-yl]propanamide CAS Name: N-[2-fluoro-9-[3-methyl-4-phenylmethoxy-5-(phenylmethoxymethyl)-2-oxolanyl]-6-purinyl]propanamide IUPAC Name: N-[2-fluoro-9-[3-methyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]propanamide Traditional Name: N-[9-[4-benzoxy-5-(benzoxymethyl)-3-methyl-tetrahydrofuran-2-yl]-2-fluoro-purin-6-yl]propionamide Formula: C28H30FN5O4 MolecularWeight: 519.567303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=NC2=C1N=CN2C3C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)C)F

Isomeric SMILES

CCC(=O)NC1=NC(=NC2=C1N=CN2C3C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)C)F

InChI

InChI=1S/C28H30FN5O4/c1-3-22(35)31-25-23-26(33-28(29)32-25)34(17-30-23)27-18(2)24(37-15-20-12-8-5-9-13-20)21(38-27)16-36-14-19-10-6-4-7-11-19/h4-13,17-18,21,24,27H,3,14-16H2,1-2H3,(H,31,32,33,35)