| SpectraBase Spectrum ID |
1wmiNSFIls2 |
| Name |
N-(4-Bromo-2-methylphenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-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 |
474.072510169 u |
| Formula |
C21H23BrN4O2S |
| InChI |
InChI=1S/C21H23BrN4O2S/c1-4-26-19(12-28-17-8-5-14(2)6-9-17)24-25-21(26)29-13-20(27)23-18-10-7-16(22)11-15(18)3/h5-11H,4,12-13H2,1-3H3,(H,23,27) |
| InChIKey |
CIZKMGLGBDRNHO-UHFFFAOYSA-N |
| Molecular Weight |
475.405 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)COC1=CC=C(C=C1)C)CC)=O)C1=C(C=C(C=C1)Br)C |
![N-(4-bromo-2-methylphenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide](/api/spectrum/1wmiNSFIls2/structure.png?h=300&w=458 "N-(4-bromo-2-methylphenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide")
