| SpectraBase Spectrum ID |
1oGJpdKK3oj |
| Name |
4-({[(2Z)-3-(4-methoxybenzyl)-4-oxo-2-(phenylimino)tetrahydro-2H-1,3-thiazin-6-yl]carbonyl}amino)benzoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
489.135842022 u |
| Formula |
C26H23N3O5S |
| InChI |
InChI=1S/C26H23N3O5S/c1-34-21-13-7-17(8-14-21)16-29-23(30)15-22(35-26(29)28-19-5-3-2-4-6-19)24(31)27-20-11-9-18(10-12-20)25(32)33/h2-14,22H,15-16H2,1H3,(H,27,31)(H,32,33)/b28-26- |
| InChIKey |
SWHYWJHTZGYAKX-SGEDCAFJSA-N |
| Molecular Weight |
489.546 g/mol |
| SMILES |
N(C(C1CC(N(\C(S1)=N\C1=CC=CC=C1)CC=1C=CC(=CC1)OC)=O)=O)C=1C=CC(C(=O)O)=CC1 |
![4-({[(2Z)-3-(4-methoxybenzyl)-4-oxo-2-(phenylimino)tetrahydro-2H-1,3-thiazin-6-yl]carbonyl}amino)benzoic acid](/api/spectrum/1oGJpdKK3oj/structure.png?h=300&w=458 "4-({[(2Z)-3-(4-methoxybenzyl)-4-oxo-2-(phenylimino)tetrahydro-2H-1,3-thiazin-6-yl]carbonyl}amino)benzoic acid")
