SpectraBase Spectrum ID |
FcbtQTtMt9X |
Name |
(E)-2-((E)-4-(4-chlorobenzylidene)-5-oxo-3-phenylthiazolidin-2-ylidene)-2-cyano-N-(3-cyano-4-(furan-2-yl)-5,6-dimethylpyridin-2-yl)acetamide |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H20ClN5O3S |
InChI |
InChI=1S/C31H20ClN5O3S/c1-18-19(2)35-28(23(16-33)27(18)26-9-6-14-40-26)36-29(38)24(17-34)30-37(22-7-4-3-5-8-22)25(31(39)41-30)15-20-10-12-21(32)13-11-20/h3-15H,1-2H3,(H,35,36,38)/b25-15+,30-24+ |
InChIKey |
LKPWUIJERRWJOL-IZHSLTDHSA-N |
Instrument Name |
Kratos MS |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.2414 |
Molecular Weight |
578.046 g/mol |
SMILES |
N(c1c(c(c(c(n1)C)C)-c1ccco1)C#N)C(\C(C#N)=C\1SC(\C(N1c1ccccc1)=C/c1ccc(cc1)Cl)=O)=O |
SPLASH |
splash10-08gi-8984220000-0b6f5362809aa19a8086 |
Source of Spectrum |
Y-53-1248-12 |
Wiley ID |
1876530 |