4,7-dimethyl-2-phenacyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-phenacyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-isopropyl-4,7-dimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-phenacyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-phenacyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-isopropyl-4,7-dimethyl-2-phenacyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C(C)C)N(C(=O)N(C3=O)CC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C(C)C)N(C(=O)N(C3=O)CC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H21N5O3/c1-12(2)25-13(3)10-23-16-17(21-19(23)25)22(4)20(28)24(18(16)27)11-15(26)14-8-6-5-7-9-14/h5-10,12H,11H2,1-4H3