5-ethyl-N-[(4-fluorophenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 5-ethyl-N-[(4-fluorophenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 5-ethyl-N-[(4-fluorophenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 5-ethyl-N-[(4-fluorophenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 5-ethyl-N-[(4-fluorophenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [5-ethyl-2-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-(4-fluorobenzyl)amine Formula: C21H19F4N3O2S MolecularWeight: 453.453073

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1NCC2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CCC1=C(N=C(N=C1NCC2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C21H19F4N3O2S/c1-3-17-18(21(23,24)25)27-19(14-6-10-16(11-7-14)31(2,29)30)28-20(17)26-12-13-4-8-15(22)9-5-13/h4-11H,3,12H2,1-2H3,(H,26,27,28)