2-(4-methoxyphenyl)-6-phenyl-9-(phenylmethyl)purine

Systemtic Name: 2-(4-methoxyphenyl)-6-phenyl-9-(phenylmethyl)purine Openeye Name: 9-benzyl-2-(4-methoxyphenyl)-6-phenyl-purine CAS Name: 2-(4-methoxyphenyl)-6-phenyl-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-2-(4-methoxyphenyl)-6-phenylpurine Traditional Name: 9-benzyl-2-(4-methoxyphenyl)-6-phenyl-purine Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C=N3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C=N3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O/c1-30-21-14-12-20(13-15-21)24-27-22(19-10-6-3-7-11-19)23-25(28-24)29(17-26-23)16-18-8-4-2-5-9-18/h2-15,17H,16H2,1H3