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

Systemtic Name: 4,7-dimethyl-2-(2-oxidanylidenepropyl)-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-acetonyl-4,7-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-(2-oxopropyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-(2-oxopropyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-acetonyl-4,7-dimethyl-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C4=CC=CC=C4)N(C(=O)N(C3=O)CC(=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C4=CC=CC=C4)N(C(=O)N(C3=O)CC(=O)C)C

InChI

InChI=1S/C18H17N5O3/c1-11-9-21-14-15(19-17(21)23(11)13-7-5-4-6-8-13)20(3)18(26)22(16(14)25)10-12(2)24/h4-9H,10H2,1-3H3