N4-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine

Systemtic Name: N4-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine Openeye Name: N4-(2-bromo-4-isopropyl-phenyl)-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine CAS Name: N4-(2-bromo-4-propan-2-ylphenyl)-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine IUPAC Name: 4-N-(2-bromo-4-propan-2-ylphenyl)-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine Traditional Name: [5-amino-2-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-(2-bromo-4-isopropyl-phenyl)amine Formula: C21H20BrF3N4 MolecularWeight: 465.30951

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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)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)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H20BrF3N4/c1-11(2)13-8-9-17(16(22)10-13)29-20-18(26)19(27-12(3)28-20)14-6-4-5-7-15(14)21(23,24)25/h4-11H,26H2,1-3H3,(H,27,28,29)