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2-[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethyloxy)phenyl]ethanamide
SpectraBase Compound ID 6lBCbfU7KVz
InChI InChI=1S/C21H14F7N3O2S/c1-31(14-6-8-15(9-7-14)33-21(26,27)28)18(32)11-34-19-29-16(10-17(30-19)20(23,24)25)12-2-4-13(22)5-3-12/h2-10H,11H2,1H3
InChIKey ZOCFDRNGXLYVNY-UHFFFAOYSA-N
Mol Weight 505.41 g/mol
Molecular Formula C21H14F7N3O2S
Exact Mass 505.069495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dhN6QBHy2l
Name 2-[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethyloxy)phenyl]ethanamide
Alternate Name(s) 2-[[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-methyl-N-[4-(trifluoromethoxy)phenyl]acetamide 2-[[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-methyl-N-[4-(trifluoromethoxy)phenyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14F7N3O2S
InChI InChI=1S/C21H14F7N3O2S/c1-31(14-6-8-15(9-7-14)33-21(26,27)28)18(32)11-34-19-29-16(10-17(30-19)20(23,24)25)12-2-4-13(22)5-3-12/h2-10H,11H2,1H3
InChIKey ZOCFDRNGXLYVNY-UHFFFAOYSA-N
Molecular Weight 505.411 g/mol
SMILES c1(nc(C(F)(F)F)cc(n1)-c1ccc(cc1)F)SCC(N(c1ccc(OC(F)(F)F)cc1)C)=O
SPLASH splash10-002u-1690000000-6d79d338f2b47c2f3653
Wiley ID 1443061