| SpectraBase Spectrum ID |
9EDf0h3fs3j |
| Name |
N-Mesityl-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)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 |
488.170453885 u |
| Formula |
C27H28N4OS2 |
| InChI |
InChI=1S/C27H28N4OS2/c1-18-9-8-10-22(15-18)31-24(16-33-23-11-6-5-7-12-23)29-30-27(31)34-17-25(32)28-26-20(3)13-19(2)14-21(26)4/h5-15H,16-17H2,1-4H3,(H,28,32) |
| InChIKey |
SRXUTMDRPYLWDJ-UHFFFAOYSA-N |
| Molecular Weight |
488.668 g/mol |
| SMILES |
N(C1=C(C=C(C=C1C)C)C)C(CSC=1N(C(=NN1)CSC=1C=CC=CC1)C=1C=C(C)C=CC1)=O |
![N-mesityl-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide](/api/spectrum/9EDf0h3fs3j/structure.png?h=300&w=458 "N-mesityl-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide")
