| SpectraBase Spectrum ID |
36wF9CKrYvf |
| Name |
N-(4-Chlorophenyl)-2-[(4-phenethyl-5-thiophen-2-yl-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 |
454.068881295 u |
| Formula |
C22H19ClN4OS2 |
| InChI |
InChI=1S/C22H19ClN4OS2/c23-17-8-10-18(11-9-17)24-20(28)15-30-22-26-25-21(19-7-4-14-29-19)27(22)13-12-16-5-2-1-3-6-16/h1-11,14H,12-13,15H2,(H,24,28) |
| InChIKey |
MWYQWXYZKAYCMN-UHFFFAOYSA-N |
| Molecular Weight |
454.994 g/mol |
| SMILES |
C=1C=CC(CCN2C(=NN=C2SCC(NC2=CC=C(Cl)C=C2)=O)C=2SC=CC2)=CC1 |
![N-(4-chlorophenyl)-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide](/api/spectrum/36wF9CKrYvf/structure.png?h=300&w=458 "N-(4-chlorophenyl)-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide")
