SpectraBase Spectrum ID |
LZFKUBH42O8 |
Name |
N-(4-Methoxy-phenyl)-3-(5-methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-propionamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.060569081 u |
Formula |
C13H15N3O2S2 |
InChI |
InChI=1S/C13H15N3O2S2/c1-9-15-16-13(20-9)19-8-7-12(17)14-10-3-5-11(18-2)6-4-10/h3-6H,7-8H2,1-2H3,(H,14,17) |
InChIKey |
PQBAWRFAQAULHS-UHFFFAOYSA-N |
Molecular Weight |
309.402 g/mol |
SMILES |
COC1=CC=C(NC(CCSC=2SC(C)=NN2)=O)C=C1 |