N4,1-diphenyl-N6-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4,1-diphenyl-N6-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4,1-diphenyl-N6-(3-pyridylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4,1-diphenyl-N6-(3-pyridinylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N,1-diphenyl-6-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (4-anilino-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-(3-pyridylmethyl)amine Formula: C23H19N7 MolecularWeight: 393.44386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCC5=CN=CC=C5

InChI

InChI=1S/C23H19N7/c1-3-9-18(10-4-1)27-21-20-16-26-30(19-11-5-2-6-12-19)22(20)29-23(28-21)25-15-17-8-7-13-24-14-17/h1-14,16H,15H2,(H2,25,27,28,29)