8-(2-azanylethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione

Systemtic Name: 8-(2-azanylethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione Openeye Name: 8-(2-aminoethylamino)-7-isobutyl-3-methyl-purine-2,6-dione CAS Name: 8-(2-aminoethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione IUPAC Name: 8-(2-aminoethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione Traditional Name: 8-(2-aminoethylamino)-7-isobutyl-3-methyl-xanthine Formula: C12H20N6O2 MolecularWeight: 280.3262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(N=C1NCCN)N(C(=O)NC2=O)C

Isomeric SMILES

CC(C)CN1C2=C(N=C1NCCN)N(C(=O)NC2=O)C

InChI

InChI=1S/C12H20N6O2/c1-7(2)6-18-8-9(15-11(18)14-5-4-13)17(3)12(20)16-10(8)19/h7H,4-6,13H2,1-3H3,(H,14,15)(H,16,19,20)