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Glycine, N-[4-[2-cyano-3-[4-[(ethylsulfonyl)amino]phenyl]-3-oxo-1-propen-1-yl]-3-methylphenyl]-N-ethyl-, 2,2,2-trifluoroethyl ester
SpectraBase Compound ID 15yzukGpAS2
InChI InChI=1S/C25H26F3N3O5S/c1-4-31(15-23(32)36-16-25(26,27)28)22-11-8-19(17(3)12-22)13-20(14-29)24(33)18-6-9-21(10-7-18)30-37(34,35)5-2/h6-13,30H,4-5,15-16H2,1-3H3/b20-13-
InChIKey PGRZLIJCWSTKFM-MOSHPQCFSA-N
Mol Weight 537.55 g/mol
Molecular Formula C25H26F3N3O5S
Exact Mass 537.154527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQDp6twSnqR
Name Glycine, N-[4-[2-cyano-3-[4-[(ethylsulfonyl)amino]phenyl]-3-oxo-1-propen-1-yl]-3-methylphenyl]-N-ethyl-, 2,2,2-trifluoroethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26F3N3O5S
InChI InChI=1S/C25H26F3N3O5S/c1-4-31(15-23(32)36-16-25(26,27)28)22-11-8-19(17(3)12-22)13-20(14-29)24(33)18-6-9-21(10-7-18)30-37(34,35)5-2/h6-13,30H,4-5,15-16H2,1-3H3/b20-13-
InChIKey PGRZLIJCWSTKFM-MOSHPQCFSA-N
Molecular Weight 537.554 g/mol
SMILES N(c1ccc(C(\C(=C/c2ccc(N(CC)CC(=O)OCC(F)(F)F)cc2C)C#N)=O)cc1)S(=O)(=O)CC
SPLASH splash10-03di-2523940000-4ed16627308b124ef8bc
Source of Spectrum JX-2015-4-1111
Synonyms (Z)-2,2,2-trifluoroethyl 2-((4-(2-cyano-3-(4-(ethylsulfonamido)phenyl)-3-oxoprop-1-en-1-yl)-3-methylphenyl)(ethyl)amino)acetate 2-[4-[(Z)-2-cyano-3-[4-(ethylsulfonylamino)phenyl]-3-oxoprop-1-enyl]-N-ethyl-3-methylanilino]acetic acid 2,2,2-trifluoroethyl ester 2,2,2-trifluoroethyl 2-[4-[(Z)-2-cyano-3-[4-(ethylsulfonylamino)phenyl]-3-oxoprop-1-enyl]-N-ethyl-3-methylanilino]acetate 2,2,2-trifluoroethyl 2-[4-[(Z)-2-cyano-3-[4-(ethylsulfonylamino)phenyl]-3-oxo-prop-1-enyl]-N-ethyl-3-methyl-anilino]acetate 2,2,2-tris(fluoranyl)ethyl 2-[[4-[(Z)-2-cyano-3-[4-(ethylsulfonylamino)phenyl]-3-oxidanylidene-prop-1-enyl]-3-methyl-phenyl]-ethyl-amino]ethanoate
Wiley ID 1726508