4-(4-chlorophenyl)-2-phenyl-N6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine

Systemtic Name: 4-(4-chlorophenyl)-2-phenyl-N6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine Openeye Name: N6-benzyl-4-(4-chlorophenyl)-2-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine CAS Name: 4-(4-chlorophenyl)-2-phenyl-N6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine IUPAC Name: 6-N-benzyl-4-(4-chlorophenyl)-2-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine Traditional Name: [3-amino-4-(4-chlorophenyl)-2-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-benzyl-amine Formula: C24H19ClN6 MolecularWeight: 426.90086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=NN(C(=C3C(=N2)C4=CC=C(C=C4)Cl)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=NN(C(=C3C(=N2)C4=CC=C(C=C4)Cl)N)C5=CC=CC=C5

InChI

InChI=1S/C24H19ClN6/c25-18-13-11-17(12-14-18)21-20-22(26)31(19-9-5-2-6-10-19)30-23(20)29-24(28-21)27-15-16-7-3-1-4-8-16/h1-14H,15,26H2,(H,27,29,30)