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

Systemtic Name: 8-(diethylamino)-3-methyl-7-propan-2-yl-purine-2,6-dione Openeye Name: 8-(diethylamino)-7-isopropyl-3-methyl-purine-2,6-dione CAS Name: 8-(diethylamino)-3-methyl-7-propan-2-ylpurine-2,6-dione IUPAC Name: 8-(diethylamino)-3-methyl-7-propan-2-ylpurine-2,6-dione Traditional Name: 8-(diethylamino)-7-isopropyl-3-methyl-xanthine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(N1C(C)C)C(=O)NC(=O)N2C

Isomeric SMILES

CCN(CC)C1=NC2=C(N1C(C)C)C(=O)NC(=O)N2C

InChI

InChI=1S/C13H21N5O2/c1-6-17(7-2)12-14-10-9(18(12)8(3)4)11(19)15-13(20)16(10)5/h8H,6-7H2,1-5H3,(H,15,19,20)