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

Systemtic Name: 1-methyl-N4-(3-methylphenyl)-N6-phenethyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: 1-methyl-N4-(m-tolyl)-N6-phenethyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 1-methyl-N4-(3-methylphenyl)-N6-phenethylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 1-methyl-4-N-(3-methylphenyl)-6-N-phenethylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [1-methyl-4-(m-toluidino)pyrazolo[3,4-d]pyrimidin-6-yl]-phenethyl-amine Formula: C21H22N6 MolecularWeight: 358.43958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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