4-methyl-2-(2-methylpropyl)-7-phenyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-2-(2-methylpropyl)-7-phenyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-isobutyl-6-isopropyl-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-2-(2-methylpropyl)-7-phenyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-2-(2-methylpropyl)-7-phenyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-isobutyl-6-isopropyl-4-methyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(N=C3N2C=C(N3C(C)C)C4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(N=C3N2C=C(N3C(C)C)C4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C21H25N5O2/c1-13(2)11-25-19(27)17-18(23(5)21(25)28)22-20-24(17)12-16(26(20)14(3)4)15-9-7-6-8-10-15/h6-10,12-14H,11H2,1-5H3