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N-(2-Pyrimidinyl)-4-[2,2,2-trifluoro-1-isovaleramido-1-(trifluoromethyl)ethylamino]benzenesulfonamide
SpectraBase Compound ID FXRn1DEUE3Y
InChI InChI=1S/C18H19F6N5O3S/c1-11(2)10-14(30)28-16(17(19,20)21,18(22,23)24)27-12-4-6-13(7-5-12)33(31,32)29-15-25-8-3-9-26-15/h3-9,11,27H,10H2,1-2H3,(H,28,30)(H,25,26,29)
InChIKey CPAKZZASGNMFCD-UHFFFAOYSA-N
Mol Weight 499.43 g/mol
Molecular Formula C18H19F6N5O3S
Exact Mass 499.11128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DM8LdHqf1fS
Name N-(2-Pyrimidinyl)-4-[2,2,2-trifluoro-1-isovaleramido-1-(trifluoromethyl)ethylamino]benzenesulfonamide
Alternate Name(s) 3-Methyl-N-[2,2,2-trifluoro-1-(4-[(2-pyrimidinylamino)sulfonyl]anilino)-1-(trifluoromethyl)ethyl]butanamide 3-Methyl-N-[2,2,2-trifluoro-1-[4-(2-pyrimidylsulfamoyl)anilino]-1-(trifluoromethyl)ethyl]butyramide 3-Methyl-N-[2,2,2-trifluoro-1-[4-(pyrimidin-2-ylsulfamoyl)anilino]-1-(trifluoromethyl)ethyl]butanamide N-[1,1,1,3,3,3-hexafluoro-2-[4-(2-pyrimidinylsulfamoyl)anilino]propan-2-yl]-3-methylbutanamide N-[1,1,1,3,3,3-hexafluoro-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]propan-2-yl]-3-methylbutanamide N-[1,1,1,3,3,3-hexakis(fluoranyl)-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]propan-2-yl]-3-methyl-butanamide
CAS Registry Number 339352-93-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19F6N5O3S
InChI InChI=1S/C18H19F6N5O3S/c1-11(2)10-14(30)28-16(17(19,20)21,18(22,23)24)27-12-4-6-13(7-5-12)33(31,32)29-15-25-8-3-9-26-15/h3-9,11,27H,10H2,1-2H3,(H,28,30)(H,25,26,29)
InChIKey CPAKZZASGNMFCD-UHFFFAOYSA-N
Molecular Weight 499.432 g/mol
SMILES N(c1ncccn1)S(c1ccc(cc1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CC(C)C)(=O)=O
SPLASH splash10-053f-9201000000-eb210ff541ac3fc53b23
Wiley ID 1468632