| SpectraBase Spectrum ID |
FTEbRrZCbPF |
| Name |
6-Benzyl-4-((1,3-diphenyl-1H-pyrazol-4-yl)methyleneamino)-3-mercapto-1,2,4-triazin-5(4H)-one |
| Appearance |
Yellow powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H20N6OS |
| InChI |
InChI=1S/C26H20N6OS/c33-25-23(16-19-10-4-1-5-11-19)28-29-26(34)32(25)27-17-21-18-31(22-14-8-3-9-15-22)30-24(21)20-12-6-2-7-13-20/h1-15,17-18H,16H2,(H,29,34)/b27-17+ |
| InChIKey |
TWXAXRNDZNMEKE-WPWMEQJKSA-N |
| Instrument Name |
Varian MAT 311A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3401 |
| Molecular Weight |
464.547 g/mol |
| SMILES |
N1N=C(C(N(C1=S)\N=C\c1c(n[n](c1)-c1ccccc1)-c1ccccc1)=O)Cc1ccccc1 |
| SPLASH |
splash10-004i-9000000000-57c6f9ccc1962e322a2f |
| Source of Spectrum |
Y-56-248-16a |
| Thin-Layer Chromatography |
Rf = 0.4 [pet. ether (60:80)/ethyl acetate (4:1)] |
| Wiley ID |
1859307 |
