| SpectraBase Spectrum ID |
AflddTvUMkQ |
| Name |
N-(4-oxo-2-Thioxo-1,4-dihydro-3(2H)-quinazolinyl)-3-phenylpropanamide # |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.088497907 u |
| Formula |
C17H15N3O2S |
| InChI |
InChI=1S/C17H15N3O2S/c21-15(11-10-12-6-2-1-3-7-12)19-20-16(22)13-8-4-5-9-14(13)18-17(20)23/h1-9H,10-11H2,(H,18,23)(H,19,21) |
| InChIKey |
MVIFHVYKZQGVTC-UHFFFAOYSA-N |
| Molecular Weight |
325.386 g/mol |
| SMILES |
C(CC(=O)NN1C(=S)NC=2C(C1=O)=CC=CC2)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876889 |
