| SpectraBase Spectrum ID |
CfpI3Ycpk8H |
| Name |
Ethyl 2-(1-benzyl-4-benzylidene-5-oxo-imidazol-2-yl)sulfanylpropanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.135113747 u |
| Formula |
C22H22N2O3S |
| InChI |
InChI=1S/C22H22N2O3S/c1-3-27-21(26)16(2)28-22-23-19(14-17-10-6-4-7-11-17)20(25)24(22)15-18-12-8-5-9-13-18/h4-14,16H,3,15H2,1-2H3/b19-14- |
| InChIKey |
TVOVQBZMTHFLAX-RGEXLXHISA-N |
| Molecular Weight |
394.489 g/mol |
| SMILES |
C1(=O)\C(N=C(N1CC1=CC=CC=C1)SC(C(=O)OCC)C)=C\C1=CC=CC=C1 |
