N4-[[4-(azetidin-1-yl)cyclohexyl]methyl]-5-fluoranyl-N2-[[2-(trifluoromethyloxy)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: N4-[[4-(azetidin-1-yl)cyclohexyl]methyl]-5-fluoranyl-N2-[[2-(trifluoromethyloxy)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: N4-[[4-(azetidin-1-yl)cyclohexyl]methyl]-5-fluoro-N2-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: N4-[[4-(1-azetidinyl)cyclohexyl]methyl]-5-fluoro-N2-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-[[4-(azetidin-1-yl)cyclohexyl]methyl]-5-fluoro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [4-(azetidin-1-yl)cyclohexyl]methyl-[5-fluoro-2-[[2-(trifluoromethoxy)benzyl]amino]pyrimidin-4-yl]amine Formula: C22H27F4N5O MolecularWeight: 453.476293

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C2CCC(CC2)CNC3=NC(=NC=C3F)NCC4=CC=CC=C4OC(F)(F)F

Isomeric SMILES

C1CN(C1)C2CCC(CC2)CNC3=NC(=NC=C3F)NCC4=CC=CC=C4OC(F)(F)F

InChI

InChI=1S/C22H27F4N5O/c23-18-14-29-21(28-13-16-4-1-2-5-19(16)32-22(24,25)26)30-20(18)27-12-15-6-8-17(9-7-15)31-10-3-11-31/h1-2,4-5,14-15,17H,3,6-13H2,(H2,27,28,29,30)