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acetamide, N-(2-benzoyl-4-chlorophenyl)-2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]-
SpectraBase Compound ID 6iIe4E6I7TE
InChI InChI=1S/C21H15ClF3N3O2S/c1-12-9-17(21(23,24)25)28-20(26-12)31-11-18(29)27-16-8-7-14(22)10-15(16)19(30)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,27,29)
InChIKey XZSKPZQAEDZRKS-UHFFFAOYSA-N
Mol Weight 465.88 g/mol
Molecular Formula C21H15ClF3N3O2S
Exact Mass 465.05256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2egMQuAsRC0
Name N-(2-benzoyl-4-chloro-phenyl)-2-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide
Alternate Name(s) N-(2-benzoyl-4-chlorophenyl)-2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide N-(2-benzoyl-4-chlorophenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClF3N3O2S
InChI InChI=1S/C21H15ClF3N3O2S/c1-12-9-17(21(23,24)25)28-20(26-12)31-11-18(29)27-16-8-7-14(22)10-15(16)19(30)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,27,29)
InChIKey XZSKPZQAEDZRKS-UHFFFAOYSA-N
Molecular Weight 465.878 g/mol
SMILES N(c1c(C(=O)c2ccccc2)cc(cc1)Cl)C(=O)CSc1nc(C(F)(F)F)cc(n1)C
SPLASH splash10-053r-2590000000-079aa4abd2ee7ea1a704
Wiley ID 1460188