8-[[(2R)-1-(2-hydroxyethylamino)butan-2-yl]amino]-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-[[(2R)-1-(2-hydroxyethylamino)butan-2-yl]amino]-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-[[(1R)-1-[(2-hydroxyethylamino)methyl]propyl]amino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[[(2R)-1-(2-hydroxyethylamino)butan-2-yl]amino]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[[(2R)-1-(2-hydroxyethylamino)butan-2-yl]amino]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[[(1R)-1-[(2-hydroxyethylamino)methyl]propyl]amino]-1,3,7-trimethyl-xanthine Formula: C14H24N6O3 MolecularWeight: 324.37876

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCCO)NC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC[C@H](CNCCO)NC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C14H24N6O3/c1-5-9(8-15-6-7-21)16-13-17-11-10(18(13)2)12(22)20(4)14(23)19(11)3/h9,15,21H,5-8H2,1-4H3,(H,16,17)/t9-/m1/s1