4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-(4-fluorobenzyl)amine Formula: C20H17F4N3O2 MolecularWeight: 407.361493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)NCC3=CC=C(C=C3)F)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)NCC3=CC=C(C=C3)F)C(F)(F)F)OC

InChI

InChI=1S/C20H17F4N3O2/c1-28-16-8-5-13(9-17(16)29-2)15-10-18(20(22,23)24)27-19(26-15)25-11-12-3-6-14(21)7-4-12/h3-10H,11H2,1-2H3,(H,25,26,27)