8-oxidanylidene-2-(4-phenylmethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 8-oxidanylidene-2-(4-phenylmethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 8-oxo-2-(4-phenylmethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 8-oxo-2-(4-phenylmethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-8-keto-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C28H25N5O6 MolecularWeight: 527.528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H25N5O6/c1-36-20-13-18(14-21(37-2)24(20)38-3)33-27-23(31-28(33)35)22(25(29)34)30-26(32-27)17-9-11-19(12-10-17)39-15-16-7-5-4-6-8-16/h4-14H,15H2,1-3H3,(H2,29,34)(H,31,35)