2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 2-(4-methylsulfonylphenyl)-N-(2-thienylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [2-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-(2-thenyl)amine Formula: C17H14F3N3O2S2 MolecularWeight: 413.43717

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)NCC3=CC=CS3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)NCC3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C17H14F3N3O2S2/c1-27(24,25)13-6-4-11(5-7-13)16-22-14(17(18,19)20)9-15(23-16)21-10-12-3-2-8-26-12/h2-9H,10H2,1H3,(H,21,22,23)