| SpectraBase Spectrum ID |
5QyYp7GMw9d |
| Name |
3-Thiophenecarboxylic acid, 4-methyl-5-[[(2-methylphenyl)amino]carbonyl]-2-[(2-thienylacetyl)amino]-, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.102099540 u |
| Formula |
C22H22N2O4S2 |
| InChI |
InChI=1S/C22H22N2O4S2/c1-4-28-22(27)18-14(3)19(20(26)23-16-10-6-5-8-13(16)2)30-21(18)24-17(25)12-15-9-7-11-29-15/h5-11H,4,12H2,1-3H3,(H,23,26)(H,24,25) |
| InChIKey |
ZAGPJASNWIVYMI-UHFFFAOYSA-N |
| Molecular Weight |
442.548 g/mol |
| SMILES |
N(C(C1=C(C(=C(S1)NC(CC=1SC=CC1)=O)C(=O)OCC)C)=O)C1=C(C)C=CC=C1 |
![3-Thiophenecarboxylic acid, 4-methyl-5-[[(2-methylphenyl)amino]carbonyl]-2-[(2-thienylacetyl)amino]-, ethyl ester](/api/spectrum/5QyYp7GMw9d/structure.png?h=300&w=458 "3-Thiophenecarboxylic acid, 4-methyl-5-[[(2-methylphenyl)amino]carbonyl]-2-[(2-thienylacetyl)amino]-, ethyl ester")
