N2-(4-methoxyphenyl)-N2,9-dimethyl-N8-(3-methylphenyl)-6-morpholin-4-yl-purine-2,8-diamine

Systemtic Name: N2-(4-methoxyphenyl)-N2,9-dimethyl-N8-(3-methylphenyl)-6-morpholin-4-yl-purine-2,8-diamine Openeye Name: N2-(4-methoxyphenyl)-N2,9-dimethyl-6-morpholino-N8-(m-tolyl)purine-2,8-diamine CAS Name: N2-(4-methoxyphenyl)-N2,9-dimethyl-N8-(3-methylphenyl)-6-(4-morpholinyl)purine-2,8-diamine IUPAC Name: 2-N-(4-methoxyphenyl)-2-N,9-dimethyl-8-N-(3-methylphenyl)-6-morpholin-4-ylpurine-2,8-diamine Traditional Name: (4-methoxyphenyl)-methyl-[9-methyl-6-morpholino-8-(m-toluidino)purin-2-yl]amine Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC3=C(N2C)N=C(N=C3N4CCOCC4)N(C)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC3=C(N2C)N=C(N=C3N4CCOCC4)N(C)C5=CC=C(C=C5)OC

InChI

InChI=1S/C25H29N7O2/c1-17-6-5-7-18(16-17)26-24-27-21-22(31(24)3)28-25(29-23(21)32-12-14-34-15-13-32)30(2)19-8-10-20(33-4)11-9-19/h5-11,16H,12-15H2,1-4H3,(H,26,27)