4-methyl-6-(4-phenoxyphenyl)-2-(phenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-6-(4-phenoxyphenyl)-2-(phenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 2-benzyl-4-methyl-6-(4-phenoxyphenyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-6-(4-phenoxyphenyl)-2-(phenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-benzyl-4-methyl-6-(4-phenoxyphenyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-benzyl-4-methyl-6-(4-phenoxyphenyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C27H23N5O3 MolecularWeight: 465.50322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N4CCN(C4=N2)C5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N4CCN(C4=N2)C5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C27H23N5O3/c1-29-24-23(25(33)32(27(29)34)18-19-8-4-2-5-9-19)31-17-16-30(26(31)28-24)20-12-14-22(15-13-20)35-21-10-6-3-7-11-21/h2-15H,16-18H2,1H3