SpectraBase Spectrum ID |
HFXEG2CHkpC |
Name |
(E)-2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)prop-2-enenitrile |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
426.003761903 u |
Formula |
C20H15BrN2O2S |
InChI |
InChI=1S/C20H15BrN2O2S/c1-24-18-8-3-13(10-19(18)25-2)9-15(11-22)20-23-17(12-26-20)14-4-6-16(21)7-5-14/h3-10,12H,1-2H3/b15-9+ |
InChIKey |
FSGKHCWZBYLSIV-OQLLNIDSSA-N |
Molecular Weight |
427.316 g/mol |
SMILES |
COC=1C=CC(\C=C\(C2=NC(=CS2)C2=CC=C(C=C2)Br)C#N)=CC1OC |