5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[2-(trifluoromethyloxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[2-(trifluoromethyloxy)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[2-(trifluoromethoxy)phenyl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[2-(trifluoromethoxy)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[2-(trifluoromethoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-[2-(trifluoromethoxy)phenyl]amine Formula: C17H14BrF3N6O MolecularWeight: 455.23187

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=CC=C4OC(F)(F)F

Isomeric SMILES

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=CC=C4OC(F)(F)F

InChI

InChI=1S/C17H14BrF3N6O/c18-10-8-22-16(23-11-3-1-2-4-13(11)28-17(19,20)21)25-15(10)24-14-7-12(26-27-14)9-5-6-9/h1-4,7-9H,5-6H2,(H3,22,23,24,25,26,27)