4,7,8-trimethyl-6-(3-morpholin-4-ylpropyl)-2-phenethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7,8-trimethyl-6-(3-morpholin-4-ylpropyl)-2-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7,8-trimethyl-6-(3-morpholinopropyl)-2-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7,8-trimethyl-6-[3-(4-morpholinyl)propyl]-2-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7,8-trimethyl-6-(3-morpholin-4-ylpropyl)-2-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7,8-trimethyl-6-(3-morpholinopropyl)-2-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H32N6O3 MolecularWeight: 464.55998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1CCCN4CCOCC4)N(C(=O)N(C3=O)CCC5=CC=CC=C5)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1CCCN4CCOCC4)N(C(=O)N(C3=O)CCC5=CC=CC=C5)C)C

InChI

InChI=1S/C25H32N6O3/c1-18-19(2)31-21-22(26-24(31)29(18)12-7-11-28-14-16-34-17-15-28)27(3)25(33)30(23(21)32)13-10-20-8-5-4-6-9-20/h4-6,8-9H,7,10-17H2,1-3H3