8-oxidanylidene-9-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 8-oxidanylidene-9-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-8-oxo-9-(tetrahydrofuran-2-ylmethyl)-7H-purine-6-carboxamide CAS Name: 8-oxo-9-(2-oxolanylmethyl)-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 8-oxo-9-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-8-keto-9-(tetrahydrofurfuryl)-7H-purine-6-carboxamide Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CN2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C24H23N5O4/c25-21(30)19-20-23(29(24(31)27-20)13-18-7-4-12-32-18)28-22(26-19)16-8-10-17(11-9-16)33-14-15-5-2-1-3-6-15/h1-3,5-6,8-11,18H,4,7,12-14H2,(H2,25,30)(H,27,31)