| SpectraBase Spectrum ID |
J94JJ9ytplH |
| Name |
N-(3-Chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-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 |
416.107374804 u |
| Formula |
C20H21ClN4O2S |
| InChI |
InChI=1S/C20H21ClN4O2S/c1-4-25-19(14-7-5-13(2)6-8-14)23-24-20(25)28-12-18(26)22-15-9-10-17(27-3)16(21)11-15/h5-11H,4,12H2,1-3H3,(H,22,26) |
| InChIKey |
QVAJRSRKQBFBCB-UHFFFAOYSA-N |
| Molecular Weight |
416.927 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C=1C=CC(=CC1)C)CC)=O)C1=CC(Cl)=C(C=C1)OC |
![N-(3-chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/J94JJ9ytplH/structure.png?h=300&w=458 "N-(3-chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
