| SpectraBase Spectrum ID |
3ITSIMgMt6 |
| Name |
Ethyl 2-(6-(4-(methylsulfonyl)phenyl)-5-(p-tolyl)-1,2,4-triazin-3-ylthio)acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21N3O4S2 |
| InChI |
InChI=1S/C21H21N3O4S2/c1-4-28-18(25)13-29-21-22-19(15-7-5-14(2)6-8-15)20(23-24-21)16-9-11-17(12-10-16)30(3,26)27/h5-12H,4,13H2,1-3H3 |
| InChIKey |
JQFWNEMSFTWLAG-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/ardp.201400400 |
| Molecular Weight |
443.536 g/mol |
| SMILES |
c1(S(=O)(=O)C)ccc(-c2c(nc(SCC(OCC)=O)nn2)-c2ccc(cc2)C)cc1 |
| SPLASH |
splash10-02vj-0914000000-75133ab97ab604118978 |
| Source of Spectrum |
APC-348-185-6b |
| Synonyms |
Ethyl 2-((6-(4-(methylsulfonyl)phenyl)-5-(p-tolyl)-1,2,4-triazin-3-yl)thio)acetate |
| Wiley ID |
1771040 |
