| SpectraBase Spectrum ID |
A1mKI0nwSfd |
| Name |
6-Benzyl-4-((1,3-diphenyl-1H-pyrazol-4-yl)methyleneamino)-3-(prop-1-enylthio)-1,2,4-triazin-5(4H)-one |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H24N6OS |
| InChI |
InChI=1S/C29H24N6OS/c1-2-18-37-29-32-31-26(19-22-12-6-3-7-13-22)28(36)35(29)30-20-24-21-34(25-16-10-5-11-17-25)33-27(24)23-14-8-4-9-15-23/h2-17,20-21H,1,18-19H2/b30-20+ |
| InChIKey |
KHELXJPCMSALAG-TWKHWXDSSA-N |
| Instrument Name |
Varian MAT 311A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3401 |
| Molecular Weight |
504.612 g/mol |
| SMILES |
C=1(C(N(C(=NN1)SCC=C)\N=C\c1c(-c2ccccc2)n[n](c1)-c1ccccc1)=O)Cc1ccccc1 |
| SPLASH |
splash10-004j-8090000000-db5c840baab1f16b0298 |
| Source of Spectrum |
Y-56-249-19 |
| Thin-Layer Chromatography |
Rf = 0.4 (pet. ether/ethyl acetate, 4:1) |
| Wiley ID |
1859310 |
