1-[[5-phenyl-3-[[2-(trifluoromethyl)phenyl]methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]amino]propan-2-ol

Systemtic Name: 1-[[5-phenyl-3-[[2-(trifluoromethyl)phenyl]methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]amino]propan-2-ol Openeye Name: 1-[[5-phenyl-3-[[2-(trifluoromethyl)phenyl]methyl]triazolo[4,5-d]pyrimidin-7-yl]amino]propan-2-ol CAS Name: 1-[[5-phenyl-3-[[2-(trifluoromethyl)phenyl]methyl]-7-triazolo[4,5-d]pyrimidinyl]amino]-2-propanol IUPAC Name: 1-[[5-phenyl-3-[[2-(trifluoromethyl)phenyl]methyl]triazolo[4,5-d]pyrimidin-7-yl]amino]propan-2-ol Traditional Name: 1-[[5-phenyl-3-[2-(trifluoromethyl)benzyl]triazolo[4,5-d]pyrimidin-7-yl]amino]propan-2-ol Formula: C21H19F3N6O MolecularWeight: 428.41037

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC(=NC2=C1N=NN2CC3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4)O

Isomeric SMILES

CC(CNC1=NC(=NC2=C1N=NN2CC3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4)O

InChI

InChI=1S/C21H19F3N6O/c1-13(31)11-25-19-17-20(27-18(26-19)14-7-3-2-4-8-14)30(29-28-17)12-15-9-5-6-10-16(15)21(22,23)24/h2-10,13,31H,11-12H2,1H3,(H,25,26,27)