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N-{4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]phenyl}-3-(trifluoromethyl)benzamide
SpectraBase Compound ID 1SqSn8xXJq
InChI InChI=1S/C22H20F3N3O2S/c23-22(24,25)17-3-1-2-16(12-17)20(29)26-18-6-4-15(5-7-18)21-27-19(14-31-21)13-28-8-10-30-11-9-28/h1-7,12,14H,8-11,13H2,(H,26,29)
InChIKey NGNHOZMZDNGWGF-UHFFFAOYSA-N
Mol Weight 447.48 g/mol
Molecular Formula C22H20F3N3O2S
Exact Mass 447.122833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LY1no6KaYx
Name N-{4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]phenyl}-3-(trifluoromethyl)benzamide
Alternate Name(s) N-[4-[4-(4-morpholinylmethyl)-2-thiazolyl]phenyl]-3-(trifluoromethyl)benzamide N-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]phenyl]-3-(trifluoromethyl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20F3N3O2S
InChI InChI=1S/C22H20F3N3O2S/c23-22(24,25)17-3-1-2-16(12-17)20(29)26-18-6-4-15(5-7-18)21-27-19(14-31-21)13-28-8-10-30-11-9-28/h1-7,12,14H,8-11,13H2,(H,26,29)
InChIKey NGNHOZMZDNGWGF-UHFFFAOYSA-N
Molecular Weight 447.476 g/mol
SMILES N(C(c1cc(C(F)(F)F)ccc1)=O)c1ccc(-c2nc(cs2)CN2CCOCC2)cc1
SPLASH splash10-03k9-3917100000-0a2ceab406aa25c79278
Source of Spectrum IY-2-5187-6
Wiley ID 1659859