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

Systemtic Name: 4-methyl-2-(2-methylprop-2-enyl)-7-phenyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-isopropyl-4-methyl-2-(2-methylallyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-2-(2-methylprop-2-enyl)-7-phenyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-2-(2-methylprop-2-enyl)-7-phenyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-isopropyl-4-methyl-2-(2-methylallyl)-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=C)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=C)C)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/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,1,11H2,2-5H3