N4-(2,5-dimethylphenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(2,5-dimethylphenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(2,5-dimethylphenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(2,5-dimethylphenyl)-N6-(4-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(2,5-dimethylphenyl)-6-N-(4-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(2,5-dimethylanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(4-methoxyphenyl)amine Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC(=NC3=C2C=NN3C)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC(=NC3=C2C=NN3C)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H22N6O/c1-13-5-6-14(2)18(11-13)24-19-17-12-22-27(3)20(17)26-21(25-19)23-15-7-9-16(28-4)10-8-15/h5-12H,1-4H3,(H2,23,24,25,26)