7-(2-diethylaminoethyl)-1,3-dimethyl-8-[oxidanyl(phenyl)methyl]purine-2,6-dione

Systemtic Name: 7-(2-diethylaminoethyl)-1,3-dimethyl-8-[oxidanyl(phenyl)methyl]purine-2,6-dione Openeye Name: 7-(2-diethylaminoethyl)-8-[hydroxy(phenyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(2-diethylaminoethyl)-8-[hydroxy(phenyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(2-diethylaminoethyl)-8-[hydroxy(phenyl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-diethylaminoethyl)-8-[hydroxy(phenyl)methyl]-1,3-dimethyl-xanthine Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=C(N=C1C(C3=CC=CC=C3)O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN(CC)CCN1C2=C(N=C1C(C3=CC=CC=C3)O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C20H27N5O3/c1-5-24(6-2)12-13-25-15-17(22(3)20(28)23(4)19(15)27)21-18(25)16(26)14-10-8-7-9-11-14/h7-11,16,26H,5-6,12-13H2,1-4H3