SpectraBase Spectrum ID |
1BKgn2YnItZ |
Name |
(6E)-6-(4-Methoxybenzylidene)-3-(2-methylphenyl)[1,3]thiazolo[2,3-C][1,2,4]triazol-5(6H)-one |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.088497907 u |
Formula |
C19H15N3O2S |
InChI |
InChI=1S/C19H15N3O2S/c1-12-5-3-4-6-15(12)17-20-21-19-22(17)18(23)16(25-19)11-13-7-9-14(24-2)10-8-13/h3-11H,1-2H3/b16-11+ |
InChIKey |
XPXXXMRRTDMLOJ-LFIBNONCSA-N |
Molecular Weight |
349.408 g/mol |
SMILES |
C1=CC=C(C=2N3C(=NN2)S\C(C3=O)=C/C=2C=CC(=CC2)OC)C(C)=C1 |