2,4-dimethyl-7-(4-methylphenyl)-6-(3-propan-2-yloxypropyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2,4-dimethyl-7-(4-methylphenyl)-6-(3-propan-2-yloxypropyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-isopropoxypropyl)-2,4-dimethyl-7-(p-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 2,4-dimethyl-7-(4-methylphenyl)-6-(3-propan-2-yloxypropyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2,4-dimethyl-7-(4-methylphenyl)-6-(3-propan-2-yloxypropyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-isopropoxypropyl)-2,4-dimethyl-7-(p-tolyl)purin[7,8-a]imidazole-1,3-quinone Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2CCCOC(C)C)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2CCCOC(C)C)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C22H27N5O3/c1-14(2)30-12-6-11-26-17(16-9-7-15(3)8-10-16)13-27-18-19(23-21(26)27)24(4)22(29)25(5)20(18)28/h7-10,13-14H,6,11-12H2,1-5H3