8-(2-hydroxyethylamino)-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione

Systemtic Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione Openeye Name: 8-(2-hydroxyethylamino)-7-isopentyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione IUPAC Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione Traditional Name: 8-(2-hydroxyethylamino)-7-isoamyl-1,3-dimethyl-xanthine Formula: C14H23N5O3 MolecularWeight: 309.36412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)CCN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C14H23N5O3/c1-9(2)5-7-19-10-11(16-13(19)15-6-8-20)17(3)14(22)18(4)12(10)21/h9,20H,5-8H2,1-4H3,(H,15,16)