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

Systemtic Name: 8-(diethylamino)-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione Openeye Name: 8-(diethylamino)-3-methyl-7-(2-methylallyl)purine-2,6-dione CAS Name: 8-(diethylamino)-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione IUPAC Name: 8-(diethylamino)-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione Traditional Name: 8-(diethylamino)-3-methyl-7-(2-methylallyl)xanthine Formula: C14H21N5O2 MolecularWeight: 291.34884

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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/C14H21N5O2/c1-6-18(7-2)13-15-11-10(19(13)8-9(3)4)12(20)16-14(21)17(11)5/h3,6-8H2,1-2,4-5H3,(H,16,20,21)