4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(thiophen-2-ylmethyl)butanamide

Systemtic Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(thiophen-2-ylmethyl)butanamide Openeye Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(2-thienylmethyl)butanamide CAS Name: 4-[[4-(2-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfonyl]-N-(thiophen-2-ylmethyl)butanamide IUPAC Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(thiophen-2-ylmethyl)butanamide Traditional Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(2-thenyl)butyramide Formula: C21H20F3N3O4S2 MolecularWeight: 499.52641

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NC(=N2)S(=O)(=O)CCCC(=O)NCC3=CC=CS3)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=N2)S(=O)(=O)CCCC(=O)NCC3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O4S2/c1-31-17-8-3-2-7-15(17)16-12-18(21(22,23)24)27-20(26-16)33(29,30)11-5-9-19(28)25-13-14-6-4-10-32-14/h2-4,6-8,10,12H,5,9,11,13H2,1H3,(H,25,28)