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N-(2-{[(4-chloro-3-methoxyphenyl)sulfonyl]amino}phenyl)-4-(trifluoromethyl)benzamide
SpectraBase Compound ID A9DreuThXi7
InChI InChI=1S/C21H16ClF3N2O4S/c1-31-19-12-15(10-11-16(19)22)32(29,30)27-18-5-3-2-4-17(18)26-20(28)13-6-8-14(9-7-13)21(23,24)25/h2-12,27H,1H3,(H,26,28)
InChIKey BQVKMDGBNFWPQE-UHFFFAOYSA-N
Mol Weight 484.88 g/mol
Molecular Formula C21H16ClF3N2O4S
Exact Mass 484.04714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLRFfxD7rSu
Name N-(2-{[(4-chloro-3-methoxyphenyl)sulfonyl]amino}phenyl)-4-(trifluoromethyl)benzamide
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Formula C21H16ClF3N2O4S
InChI InChI=1S/C21H16ClF3N2O4S/c1-31-19-12-15(10-11-16(19)22)32(29,30)27-18-5-3-2-4-17(18)26-20(28)13-6-8-14(9-7-13)21(23,24)25/h2-12,27H,1H3,(H,26,28)
InChIKey BQVKMDGBNFWPQE-UHFFFAOYSA-N
Molecular Weight 484.877 g/mol
SMILES N(S(c1cc(OC)c(cc1)Cl)(=O)=O)c1c(NC(c2ccc(C(F)(F)F)cc2)=O)cccc1
SPLASH splash10-00fs-8930000000-f1c37f23f14c5638f065
Synonyms N-[2-(4-chloro-3-methoxy-benzenesulfonylamino)-phenyl]-4-trifluoromethyl-benzamide
Wiley ID 1465167