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

Systemtic Name: 2-(4-methylsulfonylphenyl)-N-[(4-propan-2-ylphenyl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: N-[(4-isopropylphenyl)methyl]-2-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-(4-methylsulfonylphenyl)-N-[(4-propan-2-ylphenyl)methyl]-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-(4-methylsulfonylphenyl)-N-[(4-propan-2-ylphenyl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: (4-isopropylbenzyl)-[2-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C22H22F3N3O2S MolecularWeight: 449.48919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H22F3N3O2S/c1-14(2)16-6-4-15(5-7-16)13-26-20-12-19(22(23,24)25)27-21(28-20)17-8-10-18(11-9-17)31(3,29)30/h4-12,14H,13H2,1-3H3,(H,26,27,28)