6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine

Systemtic Name: 6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Openeye Name: 6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine CAS Name: 6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine IUPAC Name: 6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Traditional Name: 6-(1-adamantyl)-3-methyl-1-phenyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Formula: C24H24F3N3 MolecularWeight: 411.46267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C34CC5CC(C3)CC(C5)C4)C(F)(F)F)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C34CC5CC(C3)CC(C5)C4)C(F)(F)F)C6=CC=CC=C6

InChI

InChI=1S/C24H24F3N3/c1-14-21-19(24(25,26)27)10-20(23-11-15-7-16(12-23)9-17(8-15)13-23)28-22(21)30(29-14)18-5-3-2-4-6-18/h2-6,10,15-17H,7-9,11-13H2,1H3