N-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: N-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: N-(2-bromo-4-isopropyl-phenyl)-2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: N-(2-bromo-4-propan-2-ylphenyl)-2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: N-(2-bromo-4-propan-2-ylphenyl)-2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: (2-bromo-4-isopropyl-phenyl)-[2-methyl-5-nitro-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C21H18BrF3N4O2 MolecularWeight: 495.29243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)NC2=C(C=C(C=C2)C(C)C)Br)[N+](=O)[O-])C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=NC(=C(C(=N1)NC2=C(C=C(C=C2)C(C)C)Br)[N+](=O)[O-])C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H18BrF3N4O2/c1-11(2)13-8-9-17(16(22)10-13)28-20-19(29(30)31)18(26-12(3)27-20)14-6-4-5-7-15(14)21(23,24)25/h4-11H,1-3H3,(H,26,27,28)