1-methyl-N4-(4-methylphenyl)-N6-phenethyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: 1-methyl-N4-(4-methylphenyl)-N6-phenethyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: 1-methyl-N6-phenethyl-N4-(p-tolyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 1-methyl-N4-(4-methylphenyl)-N6-phenethylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 1-methyl-4-N-(4-methylphenyl)-6-N-phenethylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [1-methyl-6-(phenethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]-(p-tolyl)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)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H22N6/c1-15-8-10-17(11-9-15)24-19-18-14-23-27(2)20(18)26-21(25-19)22-13-12-16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3,(H2,22,24,25,26)