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

Systemtic Name: 8-ethyl-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Openeye Name: 8-ethyl-3-isobutyl-1-methyl-7H-purine-2,6-dione CAS Name: 8-ethyl-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione IUPAC Name: 8-ethyl-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Traditional Name: 8-ethyl-3-isobutyl-1-methyl-7H-purine-2,6-quinone Formula: C12H18N4O2 MolecularWeight: 250.29692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=O)N(C(=O)N2CC(C)C)C

Isomeric SMILES

CCC1=NC2=C(N1)C(=O)N(C(=O)N2CC(C)C)C

InChI

InChI=1S/C12H18N4O2/c1-5-8-13-9-10(14-8)16(6-7(2)3)12(18)15(4)11(9)17/h7H,5-6H2,1-4H3,(H,13,14)