SpectraBase Spectrum ID |
wVC9sgnCEx |
Name |
3-Dimethylamino-1-{2-[(3-chloro-4-fluoro-phenyl)-methyl-amino]-4-methyl-thiazol-5-yl}-prop-2-en-1-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H17ClFN3OS |
InChI |
InChI=1S/C16H17ClFN3OS/c1-10-15(14(22)7-8-20(2)3)23-16(19-10)21(4)11-5-6-13(18)12(17)9-11/h5-9H,1-4H3/b8-7+ |
InChIKey |
CMSUXFQSWWPWLT-BQYQJAHWSA-N |
Literature Reference DOI |
10.1002/ardp.201000238 |
Molecular Weight |
353.843 g/mol |
SMILES |
c1(sc(c(n1)C)C(\C=C\N(C)C)=O)N(c1ccc(c(c1)Cl)F)C |
SPLASH |
splash10-0pba-5904000000-f38905ef8991fb1bab43 |
Source of Spectrum |
APC-344-679-4h |
Synonyms |
(E)-1-(2-((3-chloro-4-fluorophenyl)(methyl)amino)-4-methylthiazol-5-yl)-3-(dimethylamino)prop-2-en-1-one |
Wiley ID |
1769141 |