| SpectraBase Spectrum ID |
2DDXZtnVR2C |
| Name |
2-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-4-methyl-1,3-thiazole-5-carboxylic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.098728238 u |
| Formula |
C15H18N2O4S |
| InChI |
InChI=1S/C15H18N2O4S/c1-9-13(14(18)19)22-15(17-9)16-7-6-10-4-5-11(20-2)12(8-10)21-3/h4-5,8H,6-7H2,1-3H3,(H,16,17)(H,18,19) |
| InChIKey |
IROUIXLUDVUIOP-UHFFFAOYSA-N |
| Molecular Weight |
322.379 g/mol |
| SMILES |
CC1=C(C(O)=O)SC(=N1)NCCC1=CC(OC)=C(OC)C=C1 |
![2-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-4-methyl-1,3-thiazole-5-carboxylic acid](/api/spectrum/2DDXZtnVR2C/structure.png?h=300&w=458 "2-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-4-methyl-1,3-thiazole-5-carboxylic acid")
