| SpectraBase Spectrum ID |
7JQHHVIeY8i |
| Name |
N-(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.986732113 u |
| Formula |
C19H16BrN3O2S2 |
| InChI |
InChI=1S/C19H16BrN3O2S2/c20-15-9-7-14(8-10-15)16(24)12-26-19-23-22-18(27-19)21-17(25)11-6-13-4-2-1-3-5-13/h1-5,7-10H,6,11-12H2,(H,21,22,25) |
| InChIKey |
PNHSVRCZZGJXER-UHFFFAOYSA-N |
| Molecular Weight |
462.380 g/mol |
| SMILES |
N(C=1SC(SCC(C=2C=CC(=CC2)Br)=O)=NN1)C(=O)CCC1=CC=CC=C1 |
![N-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide](/api/spectrum/7JQHHVIeY8i/structure.png?h=300&w=458 "N-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide")
