9-(5-azanylpentyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-(5-azanylpentyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-(5-aminopentyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 9-(5-aminopentyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-(5-aminopentyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 9-(5-aminopentyl)-1,3-dimethyl-xanthine Formula: C12H19N5O2 MolecularWeight: 265.31156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=CN2CCCCCN

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=CN2CCCCCN

InChI

InChI=1S/C12H19N5O2/c1-15-10-9(11(18)16(2)12(15)19)14-8-17(10)7-5-3-4-6-13/h8H,3-7,13H2,1-2H3