9-[(2R,5S)-5-(phenylmethoxymethyl)oxolan-2-yl]-1-(phenylmethyl)purin-6-one

Systemtic Name: 9-[(2R,5S)-5-(phenylmethoxymethyl)oxolan-2-yl]-1-(phenylmethyl)purin-6-one Openeye Name: 1-benzyl-9-[(2R,5S)-5-(benzyloxymethyl)tetrahydrofuran-2-yl]purin-6-one CAS Name: 9-[(2R,5S)-5-(phenylmethoxymethyl)-2-oxolanyl]-1-(phenylmethyl)-6-purinone IUPAC Name: 1-benzyl-9-[(2R,5S)-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-one Traditional Name: 9-[(2R,5S)-5-(benzoxymethyl)tetrahydrofuran-2-yl]-1-benzyl-purin-6-one Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1COCC2=CC=CC=C2)N3C=NC4=C3N=CN(C4=O)CC5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](O[C@@H]1COCC2=CC=CC=C2)N3C=NC4=C3N=CN(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C24H24N4O3/c29-24-22-23(26-16-27(24)13-18-7-3-1-4-8-18)28(17-25-22)21-12-11-20(31-21)15-30-14-19-9-5-2-6-10-19/h1-10,16-17,20-21H,11-15H2/t20-,21+/m0/s1