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

Systemtic Name: 9-(4-ethoxyphenyl)-8-oxidanylidene-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-9-(4-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-ethoxyphenyl)-8-oxo-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 9-(4-ethoxyphenyl)-8-oxo-2-(4-phenylmethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-8-keto-9-p-phenetyl-7H-purine-6-carboxamide Formula: C27H23N5O4 MolecularWeight: 481.50262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H23N5O4/c1-2-35-20-14-10-19(11-15-20)32-26-23(30-27(32)34)22(24(28)33)29-25(31-26)18-8-12-21(13-9-18)36-16-17-6-4-3-5-7-17/h3-15H,2,16H2,1H3,(H2,28,33)(H,30,34)