4-methyl-6-(3-methylphenyl)-2-(2-oxidanylidenepropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-6-(3-methylphenyl)-2-(2-oxidanylidenepropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 2-acetonyl-4-methyl-6-(m-tolyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-6-(3-methylphenyl)-2-(2-oxopropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-6-(3-methylphenyl)-2-(2-oxopropyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-acetonyl-4-methyl-6-(m-tolyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)C

InChI

InChI=1S/C18H19N5O3/c1-11-5-4-6-13(9-11)21-7-8-22-14-15(19-17(21)22)20(3)18(26)23(16(14)25)10-12(2)24/h4-6,9H,7-8,10H2,1-3H3