| SpectraBase Spectrum ID |
BI0LXx3Do4E |
| Name |
(2E)-N-[5-({2-oxo-2-[(2-Phenoxyethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-propenamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.097682865 u |
| Formula |
C21H20N4O3S2 |
| InChI |
InChI=1S/C21H20N4O3S2/c26-18(12-11-16-7-3-1-4-8-16)23-20-24-25-21(30-20)29-15-19(27)22-13-14-28-17-9-5-2-6-10-17/h1-12H,13-15H2,(H,22,27)(H,23,24,26)/b12-11+ |
| InChIKey |
MSEUVSJFMSCNHV-VAWYXSNFSA-N |
| SMILES |
N(C(CSC=1SC(=NN1)NC(\C=C\C1=CC=CC=C1)=O)=O)CCOC=1C=CC=CC1 |
![(2E)-N-[5-({2-oxo-2-[(2-phenoxyethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-propenamide](/api/spectrum/BI0LXx3Do4E/structure.png?h=300&w=458 "(2E)-N-[5-({2-oxo-2-[(2-phenoxyethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-propenamide")
