3-[3-[2-fluoranyl-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide

Systemtic Name: 3-[3-[2-fluoranyl-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide Openeye Name: 3-[3-[2-fluoro-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide CAS Name: 3-[3-[2-fluoro-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethylbenzamide IUPAC Name: 3-[3-[2-fluoro-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethylbenzamide Traditional Name: 3-[3-[2-fluoro-5-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide Formula: C22H16F4N4O MolecularWeight: 428.382253

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=CC(=C1)C2=CC3=C(NN=C3N=C2)C4=C(C=CC(=C4)C(F)(F)F)F

Isomeric SMILES

CN(C)C(=O)C1=CC=CC(=C1)C2=CC3=C(NN=C3N=C2)C4=C(C=CC(=C4)C(F)(F)F)F

InChI

InChI=1S/C22H16F4N4O/c1-30(2)21(31)13-5-3-4-12(8-13)14-9-17-19(28-29-20(17)27-11-14)16-10-15(22(24,25)26)6-7-18(16)23/h3-11H,1-2H3,(H,27,28,29)