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

Systemtic Name: N4-(4-fluorophenyl)-1-phenyl-N6-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(4-fluorophenyl)-1-phenyl-N6-(3-pyridylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(4-fluorophenyl)-1-phenyl-N6-(3-pyridinylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(4-fluorophenyl)-1-phenyl-6-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(4-fluoroanilino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(3-pyridylmethyl)amine Formula: C23H18FN7 MolecularWeight: 411.434323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)NCC4=CN=CC=C4)NC5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)NCC4=CN=CC=C4)NC5=CC=C(C=C5)F

InChI

InChI=1S/C23H18FN7/c24-17-8-10-18(11-9-17)28-21-20-15-27-31(19-6-2-1-3-7-19)22(20)30-23(29-21)26-14-16-5-4-12-25-13-16/h1-13,15H,14H2,(H2,26,28,29,30)