4-[2-fluoranyl-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidine-2,5-diamine

Systemtic Name: 4-[2-fluoranyl-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidine-2,5-diamine Openeye Name: 4-[2-fluoro-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidine-2,5-diamine CAS Name: 4-[2-fluoro-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidine-2,5-diamine IUPAC Name: 4-[2-fluoro-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidine-2,5-diamine Traditional Name: [2-amino-4-[2-fluoro-4-(trifluoromethyl)phenyl]-6-(4-methoxyphenyl)pyrimidin-5-yl]amine Formula: C18H14F4N4O MolecularWeight: 378.323573

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)N)C3=C(C=C(C=C3)C(F)(F)F)F)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)N)C3=C(C=C(C=C3)C(F)(F)F)F)N

InChI

InChI=1S/C18H14F4N4O/c1-27-11-5-2-9(3-6-11)15-14(23)16(26-17(24)25-15)12-7-4-10(8-13(12)19)18(20,21)22/h2-8H,23H2,1H3,(H2,24,25,26)