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Ethyl 2-(acetylamino)-3,3,3-trifluoro-2-(4-([(5-methyl-3-isoxazolyl)amino]sulfonyl)anilino)propanoate
SpectraBase Compound ID E8DHlVJB9Z8
InChI InChI=1S/C17H19F3N4O6S/c1-4-29-15(26)16(17(18,19)20,21-11(3)25)22-12-5-7-13(8-6-12)31(27,28)24-14-9-10(2)30-23-14/h5-9,22H,4H2,1-3H3,(H,21,25)(H,23,24)
InChIKey IEHOCILDLZERNJ-UHFFFAOYSA-N
Mol Weight 464.42 g/mol
Molecular Formula C17H19F3N4O6S
Exact Mass 464.09774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMojZRveoZy
Name ETHYL 2-ACETAMIDO-3,3,3-TRIFLUORO-2-{4-[(5-METHYL-3-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H19F3N4O6S
InChI InChI=1S/C17H19F3N4O6S/c1-4-29-15(26)16(17(18,19)20,21-11(3)25)22-12-5-7-13(8-6-12)31(27,28)24-14-9-10(2)30-23-14/h5-9,22H,4H2,1-3H3,(H,21,25)(H,23,24)
InChIKey IEHOCILDLZERNJ-UHFFFAOYSA-N
Molecular Weight 464.0973
SMILES N(c1ccc(S(Nc2noc(C)c2)(=O)=O)cc1)C(C(F)(F)F)(NC(C)=O)C(=O)OCC
SPLASH splash10-0006-9100000000-df63ce45b93311a6ff4b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany