4,7,8-trimethyl-2-phenacyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7,8-trimethyl-2-phenacyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7,8-trimethyl-2-phenacyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7,8-trimethyl-2-phenacyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7,8-trimethyl-2-phenacyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7,8-trimethyl-2-phenacyl-6-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)CC(=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)CC(=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C26H25N5O3/c1-17-18(2)31-22-23(27-25(31)29(17)15-14-19-10-6-4-7-11-19)28(3)26(34)30(24(22)33)16-21(32)20-12-8-5-9-13-20/h4-13H,14-16H2,1-3H3