| SpectraBase Spectrum ID |
Cq5L5zCNWVB |
| Name |
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-methoxyphenyl)methylene]amino]-2-methyl-5-(methylthio)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.060903434 u |
| Formula |
C12H14N4OS2 |
| InChI |
InChI=1S/C12H14N4OS2/c1-15-12(18)16(11(14-15)19-3)13-8-9-4-6-10(17-2)7-5-9/h4-8H,1-3H3/b13-8+ |
| InChIKey |
UMQOYLIAMSHDHR-MDWZMJQESA-N |
| Molecular Weight |
294.391 g/mol |
| SMILES |
C1(N(C(=NN1C)SC)\N=C\C=1C=CC(=CC1)OC)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921102 |
![3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-methoxyphenyl)methylene]amino]-2-methyl-5-(methylthio)-](/api/spectrum/Cq5L5zCNWVB/structure.png?h=300&w=458 "3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-methoxyphenyl)methylene]amino]-2-methyl-5-(methylthio)-")
