N4-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (6-amino-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-(3-chlorobenzyl)amine Formula: C12H11ClN6 MolecularWeight: 274.70894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CNC2=NC(=NC3=C2C=NN3)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CNC2=NC(=NC3=C2C=NN3)N

InChI

InChI=1S/C12H11ClN6/c13-8-3-1-2-7(4-8)5-15-10-9-6-16-19-11(9)18-12(14)17-10/h1-4,6H,5H2,(H4,14,15,16,17,18,19)