N4-[3-(3-azanylpropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine

Systemtic Name: N4-[3-(3-azanylpropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N4-[3-(3-aminopropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N4-[3-(3-aminopropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 4-N-[3-(3-aminopropyl)phenyl]-3-N-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [4-[3-(3-aminopropyl)anilino]-2H-pyrazolo[3,4-d]pyrimidin-3-yl]-phenyl-amine Formula: C20H21N7 MolecularWeight: 359.42764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=NN2)N=CN=C3NC4=CC=CC(=C4)CCCN

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=NN2)N=CN=C3NC4=CC=CC(=C4)CCCN

InChI

InChI=1S/C20H21N7/c21-11-5-7-14-6-4-10-16(12-14)25-18-17-19(23-13-22-18)26-27-20(17)24-15-8-2-1-3-9-15/h1-4,6,8-10,12-13H,5,7,11,21H2,(H3,22,23,24,25,26,27)