7-(3-methoxyphenyl)-2,4-dimethyl-6-(4-oxidanylbutyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 7-(3-methoxyphenyl)-2,4-dimethyl-6-(4-oxidanylbutyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-hydroxybutyl)-7-(3-methoxyphenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-hydroxybutyl)-7-(3-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-hydroxybutyl)-7-(3-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-hydroxybutyl)-7-(3-methoxyphenyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCCCO)C4=CC(=CC=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCCCO)C4=CC(=CC=C4)OC

InChI

InChI=1S/C20H23N5O4/c1-22-17-16(18(27)23(2)20(22)28)25-12-15(13-7-6-8-14(11-13)29-3)24(19(25)21-17)9-4-5-10-26/h6-8,11-12,26H,4-5,9-10H2,1-3H3