| SpectraBase Spectrum ID |
7cwrqE3Agsl |
| Name |
1,3-Dibenzoyl-4-benzylidene-5-oxo-2-thiocarbonylimidazolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.088163554 u |
| Formula |
C24H16N2O3S |
| InChI |
InChI=1S/C24H16N2O3S/c27-21(18-12-6-2-7-13-18)25-20(16-17-10-4-1-5-11-17)23(29)26(24(25)30)22(28)19-14-8-3-9-15-19/h1-16H/b20-16+ |
| InChIKey |
WUGXLOXVBONSMU-CAPFRKAQSA-N |
| Molecular Weight |
412.463 g/mol |
| SMILES |
C1=CC=CC(=C1)\C=C/1C(=O)N(C(N1C(=O)C1=CC=CC=C1)=S)C(C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841265 |
