| SpectraBase Spectrum ID |
KzkQeXHeV41 |
| Name |
(7Z)-3-(4-Methoxyphenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-A][1,3,5]triazin-6(7H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
441.135842022 u |
| Formula |
C22H23N3O5S |
| InChI |
InChI=1S/C22H23N3O5S/c1-27-16-7-5-15(6-8-16)24-12-23-22-25(13-24)21(26)19(31-22)11-14-9-17(28-2)20(30-4)18(10-14)29-3/h5-11H,12-13H2,1-4H3/b19-11- |
| InChIKey |
VQPNTJSEYBACON-ODLFYWEKSA-N |
| Molecular Weight |
441.502 g/mol |
| SMILES |
COC1=CC=C(N2CN3C(=NC2)S\C(C3=O)=C\C2=CC(OC)=C(C(=C2)OC)OC)C=C1 |