(2R,3R,5R)-5-[2-azanyl-6-[[bis(4-methoxyphenyl)-phenyl-methyl]amino]purin-9-yl]-4,4-bis(fluoranyl)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: (2R,3R,5R)-5-[2-azanyl-6-[[bis(4-methoxyphenyl)-phenyl-methyl]amino]purin-9-yl]-4,4-bis(fluoranyl)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: (2R,3R,5R)-5-[2-amino-6-[[bis(4-methoxyphenyl)-phenyl-methyl]amino]purin-9-yl]-4,4-difluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2R,3R,5R)-5-[2-amino-6-[[bis(4-methoxyphenyl)-phenylmethyl]amino]-9-purinyl]-4,4-difluoro-2-(hydroxymethyl)-3-oxolanol IUPAC Name: (2R,3R,5R)-5-[2-amino-6-[[bis(4-methoxyphenyl)-phenylmethyl]amino]purin-9-yl]-4,4-difluoro-2-(hydroxymethyl)oxolan-3-ol Traditional Name: (2R,3R,5R)-5-[2-amino-6-[[bis(4-methoxyphenyl)-phenyl-methyl]amino]purin-9-yl]-4,4-difluoro-2-methylol-tetrahydrofuran-3-ol Formula: C31H30F2N6O5 MolecularWeight: 604.603906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)NC4=NC(=NC5=C4N=CN5C6C(C(C(O6)CO)O)(F)F)N

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)NC4=NC(=NC5=C4N=CN5[C@H]6C([C@@H]([C@H](O6)CO)O)(F)F)N

InChI

InChI=1S/C31H30F2N6O5/c1-42-21-12-8-19(9-13-21)30(18-6-4-3-5-7-18,20-10-14-22(43-2)15-11-20)38-26-24-27(37-29(34)36-26)39(17-35-24)28-31(32,33)25(41)23(16-40)44-28/h3-15,17,23,25,28,40-41H,16H2,1-2H3,(H3,34,36,37,38)/t23-,25-,28-/m1/s1