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

Systemtic Name: 6-(2-ethylphenyl)-4-methyl-2-(3-phenylpropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-ethylphenyl)-4-methyl-2-(3-phenylpropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-ethylphenyl)-4-methyl-2-(3-phenylpropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-ethylphenyl)-4-methyl-2-(3-phenylpropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-ethylphenyl)-4-methyl-2-(3-phenylpropyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCCC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC=C1N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCCC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2/c1-3-19-13-7-8-14-20(19)28-16-17-29-21-22(26-24(28)29)27(2)25(32)30(23(21)31)15-9-12-18-10-5-4-6-11-18/h4-8,10-11,13-14H,3,9,12,15-17H2,1-2H3