N4-(3-chlorophenyl)-N3-methyl-N3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine

Systemtic Name: N4-(3-chlorophenyl)-N3-methyl-N3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N4-(3-chlorophenyl)-N3-methyl-N3-(2-naphthyl)-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N4-(3-chlorophenyl)-N3-methyl-N3-(2-naphthalenyl)-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 4-N-(3-chlorophenyl)-3-N-methyl-3-N-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [4-(3-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-methyl-(2-naphthyl)amine Formula: C22H17ClN6 MolecularWeight: 400.86358

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=CC=CC=C2C=C1)C3=NNC4=C3C(=NC=N4)NC5=CC(=CC=C5)Cl

Isomeric SMILES

CN(C1=CC2=CC=CC=C2C=C1)C3=NNC4=C3C(=NC=N4)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H17ClN6/c1-29(18-10-9-14-5-2-3-6-15(14)11-18)22-19-20(24-13-25-21(19)27-28-22)26-17-8-4-7-16(23)12-17/h2-13H,1H3,(H2,24,25,26,27,28)