8-(2-dimethylaminoethylamino)-1,3-dimethyl-7-(2-oxidanyl-2-phenyl-ethyl)purine-2,6-dione

Systemtic Name: 8-(2-dimethylaminoethylamino)-1,3-dimethyl-7-(2-oxidanyl-2-phenyl-ethyl)purine-2,6-dione Openeye Name: 8-(2-dimethylaminoethylamino)-7-(2-hydroxy-2-phenyl-ethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(2-dimethylaminoethylamino)-7-(2-hydroxy-2-phenylethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-(2-dimethylaminoethylamino)-7-(2-hydroxy-2-phenylethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(2-dimethylaminoethylamino)-7-(2-hydroxy-2-phenyl-ethyl)-1,3-dimethyl-xanthine Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCN(C)C)CC(C3=CC=CC=C3)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCN(C)C)CC(C3=CC=CC=C3)O

InChI

InChI=1S/C19H26N6O3/c1-22(2)11-10-20-18-21-16-15(17(27)24(4)19(28)23(16)3)25(18)12-14(26)13-8-6-5-7-9-13/h5-9,14,26H,10-12H2,1-4H3,(H,20,21)