8-(4-ethoxyphenyl)-1-methyl-5-phenethyl-purino[8,9-c][1,2,4]triazole-2,4-dione

Systemtic Name: 8-(4-ethoxyphenyl)-1-methyl-5-phenethyl-purino[8,9-c][1,2,4]triazole-2,4-dione Openeye Name: 8-(4-ethoxyphenyl)-1-methyl-5-phenethyl-purino[8,9-c][1,2,4]triazole-2,4-dione CAS Name: 8-(4-ethoxyphenyl)-1-methyl-5-phenethylpurino[8,9-c][1,2,4]triazole-2,4-dione IUPAC Name: 8-(4-ethoxyphenyl)-1-methyl-5-phenethylpurino[8,9-c][1,2,4]triazole-2,4-dione Traditional Name: 1-methyl-5-phenethyl-8-p-phenetyl-purino[8,9-c][1,2,4]triazole-2,4-quinone Formula: C23H22N6O3 MolecularWeight: 430.45918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C3N2C4=C(N3CCC5=CC=CC=C5)C(=O)NC(=O)N4C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C3N2C4=C(N3CCC5=CC=CC=C5)C(=O)NC(=O)N4C

InChI

InChI=1S/C23H22N6O3/c1-3-32-17-11-9-16(10-12-17)19-25-26-22-28(14-13-15-7-5-4-6-8-15)18-20(30)24-23(31)27(2)21(18)29(19)22/h4-12H,3,13-14H2,1-2H3,(H,24,30,31)