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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-5-methyl-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-5-methyl-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-[(4-methoxyphenyl)methyl]-5-methyl-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-[(4-methoxyphenyl)methyl]-5-methyl-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-(4-mesylphenyl)-5-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-p-anisyl-amine Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C(F)(F)F)NCC2=CC=C(C=C2)OC)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(N=C(N=C1C(F)(F)F)NCC2=CC=C(C=C2)OC)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H20F3N3O3S/c1-13-18(15-6-10-17(11-7-15)31(3,28)29)26-20(27-19(13)21(22,23)24)25-12-14-4-8-16(30-2)9-5-14/h4-11H,12H2,1-3H3,(H,25,26,27)