6-(3-methylsulfonylphenyl)-N-[4-(trifluoromethyloxy)phenyl]pyrimidin-4-amine

Systemtic Name: 6-(3-methylsulfonylphenyl)-N-[4-(trifluoromethyloxy)phenyl]pyrimidin-4-amine Openeye Name: 6-(3-methylsulfonylphenyl)-N-[4-(trifluoromethoxy)phenyl]pyrimidin-4-amine CAS Name: 6-(3-methylsulfonylphenyl)-N-[4-(trifluoromethoxy)phenyl]-4-pyrimidinamine IUPAC Name: 6-(3-methylsulfonylphenyl)-N-[4-(trifluoromethoxy)phenyl]pyrimidin-4-amine Traditional Name: [6-(3-mesylphenyl)pyrimidin-4-yl]-[4-(trifluoromethoxy)phenyl]amine Formula: C18H14F3N3O3S MolecularWeight: 409.38227

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H14F3N3O3S/c1-28(25,26)15-4-2-3-12(9-15)16-10-17(23-11-22-16)24-13-5-7-14(8-6-13)27-18(19,20)21/h2-11H,1H3,(H,22,23,24)