N-[(4-methoxyphenyl)methyl]-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-[(4-methoxyphenyl)methyl]-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-p-anisyl-amine Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H18F3N3O3S/c1-29-15-7-3-13(4-8-15)12-24-19-25-17(11-18(26-19)20(21,22)23)14-5-9-16(10-6-14)30(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26)