SpectraBase Spectrum ID |
EavH4JgytUk |
Name |
2-({5-[(4-Ethoxyanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
383.141596108 u |
Formula |
C19H21N5O2S |
InChI |
InChI=1S/C19H21N5O2S/c1-2-26-16-10-8-14(9-11-16)21-12-18-22-23-19(27-13-17(20)25)24(18)15-6-4-3-5-7-15/h3-11,21H,2,12-13H2,1H3,(H2,20,25) |
InChIKey |
WAQKXFSHZQRWFH-UHFFFAOYSA-N |
Molecular Weight |
383.470 g/mol |
SMILES |
N(CC=1N(C(SCC(=O)N)=NN1)C=1C=CC=CC1)C1=CC=C(OCC)C=C1 |