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

Systemtic Name: N4-[4-(3-azanylpropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N4-[4-(3-aminopropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N4-[4-(3-aminopropyl)phenyl]-N3-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 4-N-[4-(3-aminopropyl)phenyl]-3-N-phenyl-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [4-[4-(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=C(C=C4)CCCN

Isomeric SMILES

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

InChI

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