N3-(3-methylphenyl)-N4-(1-phenylethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine

Systemtic Name: N3-(3-methylphenyl)-N4-(1-phenylethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N3-(m-tolyl)-N4-(1-phenylethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N3-(3-methylphenyl)-N4-(1-phenylethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 3-N-(3-methylphenyl)-4-N-(1-phenylethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [3-(m-toluidino)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-(1-phenylethyl)amine Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C3C(=NN2)N=CN=C3NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C3C(=NN2)N=CN=C3NC(C)C4=CC=CC=C4

InChI

InChI=1S/C20H20N6/c1-13-7-6-10-16(11-13)24-20-17-18(21-12-22-19(17)25-26-20)23-14(2)15-8-4-3-5-9-15/h3-12,14H,1-2H3,(H3,21,22,23,24,25,26)