| SpectraBase Spectrum ID |
1xHFZs58PBV |
| Name |
S-(2,4-Dioxo-1,3-diphenylquinolin-3-yl) carbamothioate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.088163554 u |
| Formula |
C22H16N2O3S |
| InChI |
InChI=1S/C22H16N2O3S/c23-21(27)28-22(15-9-3-1-4-10-15)19(25)17-13-7-8-14-18(17)24(20(22)26)16-11-5-2-6-12-16/h1-14H,(H2,23,27) |
| InChIKey |
GCGFUYWKCYWSIW-UHFFFAOYSA-N |
| Molecular Weight |
388.441 g/mol |
| SMILES |
C(N)(=O)SC1(C(N(C2=C(C1=O)C=CC=C2)C=1C=CC=CC1)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936159 |
