8-(4-ethanoylpiperazin-1-yl)-7-ethyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-(4-ethanoylpiperazin-1-yl)-7-ethyl-3-methyl-purine-2,6-dione Openeye Name: 8-(4-acetylpiperazin-1-yl)-7-ethyl-3-methyl-purine-2,6-dione CAS Name: 8-(4-acetyl-1-piperazinyl)-7-ethyl-3-methylpurine-2,6-dione IUPAC Name: 8-(4-acetylpiperazin-1-yl)-7-ethyl-3-methylpurine-2,6-dione Traditional Name: 8-(4-acetylpiperazino)-7-ethyl-3-methyl-xanthine Formula: C14H20N6O3 MolecularWeight: 320.347

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1N3CCN(CC3)C(=O)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCN1C2=C(N=C1N3CCN(CC3)C(=O)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C14H20N6O3/c1-4-20-10-11(17(3)14(23)16-12(10)22)15-13(20)19-7-5-18(6-8-19)9(2)21/h4-8H2,1-3H3,(H,16,22,23)