8-(2-fluorophenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione

Systemtic Name: 8-(2-fluorophenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Openeye Name: 8-(2-fluorophenyl)-3-isobutyl-1-methyl-7H-purine-2,6-dione CAS Name: 8-(2-fluorophenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione IUPAC Name: 8-(2-fluorophenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Traditional Name: 8-(2-fluorophenyl)-3-isobutyl-1-methyl-7H-purine-2,6-quinone Formula: C16H17FN4O2 MolecularWeight: 316.330183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=CC=C3F

Isomeric SMILES

CC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=CC=C3F

InChI

InChI=1S/C16H17FN4O2/c1-9(2)8-21-14-12(15(22)20(3)16(21)23)18-13(19-14)10-6-4-5-7-11(10)17/h4-7,9H,8H2,1-3H3,(H,18,19)