SpectraBase Spectrum ID |
DUxFQDmSKZ |
Name |
2-[4-(2-Cyanoethylthio)-5-ethylthio-1,3-dithiole-2-ylidene]-5-tosyl-1,3-dithio[4,5-c]pyrrole |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H18N2O2S7 |
InChI |
InChI=1S/C20H18N2O2S7/c1-3-25-17-18(26-10-4-9-21)30-20(29-17)19-27-15-11-22(12-16(15)28-19)31(23,24)14-7-5-13(2)6-8-14/h5-8,11-12H,3-4,10H2,1-2H3 |
InChIKey |
UQCZTNLOWIRLTE-UHFFFAOYSA-N |
Molecular Weight |
542.796 g/mol |
SMILES |
c1[n](S(c2ccc(cc2)C)(=O)=O)cc2SC(Sc12)=C1SC(SCCC#N)=C(S1)SCC |
SPLASH |
splash10-0a5c-3901010000-46e937adaf022263fa62 |
Source of Spectrum |
QE-20-275-22 |
Wiley ID |
1586635 |