[(2R,3R,4S)-5-(6-benzamidopurin-9-yl)-4-fluoranyl-3-oxidanyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [(2R,3R,4S)-5-(6-benzamidopurin-9-yl)-4-fluoranyl-3-oxidanyl-oxolan-2-yl]methyl benzoate Openeye Name: [(2R,3R,4S)-5-(6-benzamidopurin-9-yl)-4-fluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R,4S)-5-(6-benzamido-9-purinyl)-4-fluoro-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4S)-5-(6-benzamidopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R,4S)-5-(6-benzamidopurin-9-yl)-4-fluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C24H20FN5O5 MolecularWeight: 477.444503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)COC(=O)C5=CC=CC=C5)O)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3C4[C@H]([C@@H]([C@H](O4)COC(=O)C5=CC=CC=C5)O)F

InChI

InChI=1S/C24H20FN5O5/c25-17-19(31)16(11-34-24(33)15-9-5-2-6-10-15)35-23(17)30-13-28-18-20(26-12-27-21(18)30)29-22(32)14-7-3-1-4-8-14/h1-10,12-13,16-17,19,23,31H,11H2,(H,26,27,29,32)/t16-,17+,19-,23?/m1/s1