8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(4-dimethylaminophenyl)-7-(4-methoxyphenyl)-1,3-dimethyl-xanthine Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H23N5O3/c1-24(2)15-8-6-14(7-9-15)19-23-20-18(21(28)26(4)22(29)25(20)3)27(19)16-10-12-17(30-5)13-11-16/h6-13H,1-5H3