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

Systemtic Name: N4-(2,4-dimethylphenyl)-1-methyl-N6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-(2,4-dimethylphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(2,4-dimethylphenyl)-1-methyl-N6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-(2,4-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: benzyl-[4-(2,4-dimethylanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C21H22N6 MolecularWeight: 358.43958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC(=NC3=C2C=NN3C)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC(=NC3=C2C=NN3C)NCC4=CC=CC=C4)C

InChI

InChI=1S/C21H22N6/c1-14-9-10-18(15(2)11-14)24-19-17-13-23-27(3)20(17)26-21(25-19)22-12-16-7-5-4-6-8-16/h4-11,13H,12H2,1-3H3,(H2,22,24,25,26)