6-methyl-N-(quinolin-4-ylmethyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine

Systemtic Name: 6-methyl-N-(quinolin-4-ylmethyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine Openeye Name: 6-methyl-N-(4-quinolylmethyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine CAS Name: 6-methyl-N-(4-quinolinylmethyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine IUPAC Name: 6-methyl-N-(quinolin-4-ylmethyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine Traditional Name: [6-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-(4-quinolylmethyl)amine Formula: C18H14F3N5 MolecularWeight: 357.33247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(F)(F)F)C(=NN2)NCC3=CC=NC4=CC=CC=C34

Isomeric SMILES

CC1=NC2=C(C(=C1)C(F)(F)F)C(=NN2)NCC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C18H14F3N5/c1-10-8-13(18(19,20)21)15-16(25-26-17(15)24-10)23-9-11-6-7-22-14-5-3-2-4-12(11)14/h2-8H,9H2,1H3,(H2,23,24,25,26)