4-methyl-2-(naphthalen-1-ylmethyl)-6-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-2-(naphthalen-1-ylmethyl)-6-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 4-methyl-2-(1-naphthylmethyl)-6-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-2-(1-naphthalenylmethyl)-6-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-2-(naphthalen-1-ylmethyl)-6-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 4-methyl-2-(1-naphthylmethyl)-6-phenethyl-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC4=CC=CC=C43)N5CCN(C5=N2)CCC6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC4=CC=CC=C43)N5CCN(C5=N2)CCC6=CC=CC=C6

InChI

InChI=1S/C27H25N5O2/c1-29-24-23(31-17-16-30(26(31)28-24)15-14-19-8-3-2-4-9-19)25(33)32(27(29)34)18-21-12-7-11-20-10-5-6-13-22(20)21/h2-13H,14-18H2,1H3