| SpectraBase Spectrum ID |
3420vnr46q |
| Name |
3-(2-(5-Mercapto-1,3,4-oxadiazol-2-yl)-4-oxo-4-(p-tolyl)but-1-en-1-yl)quinolin-2(1H)-one |
| Appearance |
Off-white crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H17N3O3S |
| InChI |
InChI=1S/C22H17N3O3S/c1-13-6-8-14(9-7-13)19(26)12-17(21-24-25-22(29)28-21)11-16-10-15-4-2-3-5-18(15)23-20(16)27/h2-11H,12H2,1H3,(H,23,27)(H,25,29) |
| InChIKey |
FSMZKZLXHNVOCK-UHFFFAOYSA-N |
| Instrument Name |
Thermo Scientific ISQ LT |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/jhet.4233 |
| Molecular Weight |
403.456 g/mol |
| SMILES |
Sc1nnc(C(=CC=2C(Nc3c(C2)cccc3)=O)CC(c2ccc(cc2)C)=O)o1 |
| SPLASH |
splash10-0a6u-3696000000-16219f6f9609e822f8b1 |
| Source of Spectrum |
Y-58-SM27-11 |
| Wiley ID |
1880915 |
