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

Systemtic Name: 8-(diethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione Openeye Name: 8-(diethylamino)-7-isobutyl-3-methyl-purine-2,6-dione CAS Name: 8-(diethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione IUPAC Name: 8-(diethylamino)-3-methyl-7-(2-methylpropyl)purine-2,6-dione Traditional Name: 8-(diethylamino)-7-isobutyl-3-methyl-xanthine Formula: C14H23N5O2 MolecularWeight: 293.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2C

Isomeric SMILES

CCN(CC)C1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2C

InChI

InChI=1S/C14H23N5O2/c1-6-18(7-2)13-15-11-10(19(13)8-9(3)4)12(20)16-14(21)17(11)5/h9H,6-8H2,1-5H3,(H,16,20,21)