SpectraBase Spectrum ID |
BZTsmI9XykL |
Name |
[4-tert-Butyl-3-(3-trifluoromethylphenyl)-2,3-dihydrothiazol-2-ylidene]-4-nitrophenylacetonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H18F3N3O2S |
InChI |
InChI=1S/C22H18F3N3O2S/c1-21(2,3)19-13-31-20(18(12-26)14-7-9-16(10-8-14)28(29)30)27(19)17-6-4-5-15(11-17)22(23,24)25/h4-11,13H,1-3H3/b20-18- |
InChIKey |
WFGOGNROJJVIPF-ZZEZOPTASA-N |
Literature Reference DOI |
10.1002_1521-3897(200006)342_6_554 |
Molecular Weight |
445.460 g/mol |
SMILES |
c1ccc(cc1C(F)(F)F)N1C(=CS\C1=C\(c1ccc(cc1)[N+](=O)[O-])C#N)C(C)(C)C |
SPLASH |
splash10-0002-0000900000-e600d9d14e7e2cce91f1 |
Source of Spectrum |
JF-342-558-6a |
Synonyms |
(E)-2-(4-(tert-butyl)-3-(3-(trifluoromethyl)phenyl)thiazol-2(3H)-ylidene)-2-(4-nitrophenyl)acetonitrile |
Wiley ID |
1767044 |