7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethyl-8-phenylazanyl-purine-2,6-dione

Systemtic Name: 7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethyl-8-phenylazanyl-purine-2,6-dione Openeye Name: 8-anilino-7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-anilino-7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-anilino-7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-anilino-7-[2-(2,5-dimethylphenyl)ethyl]-1,3-dimethyl-xanthine Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CCN2C3=C(N=C2NC4=CC=CC=C4)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CCN2C3=C(N=C2NC4=CC=CC=C4)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C23H25N5O2/c1-15-10-11-16(2)17(14-15)12-13-28-19-20(26(3)23(30)27(4)21(19)29)25-22(28)24-18-8-6-5-7-9-18/h5-11,14H,12-13H2,1-4H3,(H,24,25)