3-[3,6-dimethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile

Systemtic Name: 3-[3,6-dimethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Openeye Name: 3-[3,6-dimethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile CAS Name: 3-[3,6-dimethyl-4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]propanenitrile IUPAC Name: 3-[3,6-dimethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Traditional Name: 3-[3,6-dimethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propionitrile Formula: C12H11F3N4 MolecularWeight: 268.23775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2CCC#N)C)C(=C1)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(C(=NN2CCC#N)C)C(=C1)C(F)(F)F

InChI

InChI=1S/C12H11F3N4/c1-7-6-9(12(13,14)15)10-8(2)18-19(5-3-4-16)11(10)17-7/h6H,3,5H2,1-2H3