SpectraBase Spectrum ID |
9mYCaB7YNQ1 |
Name |
2-Thiazoleacetonitrile, alpha-[(4-chlorophenyl)methylene]-4-phenyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
322.033147236 u |
Formula |
C18H11ClN2S |
InChI |
InChI=1S/C18H11ClN2S/c19-16-8-6-13(7-9-16)10-15(11-20)18-21-17(12-22-18)14-4-2-1-3-5-14/h1-10,12H/b15-10+ |
InChIKey |
DGYIXQYTFLVTQV-XNTDXEJSSA-N |
Molecular Weight |
322.813 g/mol |
SMILES |
C=1C=CC(C=2N=C(\C(=C\C3=CC=C(C=C3)Cl)C#N)SC2)=CC1 |