| SpectraBase Spectrum ID |
Ha6hTbn60 |
| Name |
(2-((4-((E)-(4-chloro-3-cyano-5- ((E)-((2,3-dimethylphenyl)imino)methyl)thiophen-2-yl)diazenyl) phenyl)(2-cyanoethyl)amino)ethyl acetate) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H25ClN6O2S |
| InChI |
InChI=1S/C27H25ClN6O2S/c1-18-6-4-7-24(19(18)2)31-17-25-26(28)23(16-30)27(37-25)33-32-21-8-10-22(11-9-21)34(13-5-12-29)14-15-36-20(3)35/h4,6-11,17H,5,13-15H2,1-3H3/b31-17+,33-32+ |
| InChIKey |
KSIZAKZTUPJOGV-ARWKGFMTSA-N |
| Molecular Weight |
533.050 g/mol |
| SMILES |
C(C)(=O)OCCN(CCC#N)c1ccc(cc1)\N=N\c1c(c(c(s1)\C=N\c1c(c(ccc1)C)C)Cl)C#N |
| SPLASH |
splash10-056r-0421920000-e60cb272e34fa379db1a |
| Source of Spectrum |
Dan Xu, et al. Dyes and Pigments, V.133, 2016, P.143-152 |
| Synonyms |
2-((4-((E)-(4-chloro-3-cyano-5-((E)-((2,3-dimethylphenyl)imino)methyl)thiophen-2-yl)diazenyl)phenyl)(2-cyanoethyl)amino)ethyl acetate |
| Wiley ID |
1816501 |
