6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-[2-(3,4-diethoxyphenyl)ethyl]-2,4,8-trimethyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C28H31N5O4 MolecularWeight: 501.57684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCN2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)C)C)C5=CC=CC=C5)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCN2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)C)C)C5=CC=CC=C5)OCC

InChI

InChI=1S/C28H31N5O4/c1-6-36-21-14-13-19(17-22(21)37-7-2)15-16-32-23(20-11-9-8-10-12-20)18(3)33-24-25(29-27(32)33)30(4)28(35)31(5)26(24)34/h8-14,17H,6-7,15-16H2,1-5H3