| SpectraBase Spectrum ID |
1NZ2Vm59gfb |
| Name |
5-Acetyl-4-methyl-2-[(2-phenyl-cyclopropanecarbonyl)-amino]-thiophene-3-carboxylic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.119129330 u |
| Formula |
C20H21NO4S |
| InChI |
InChI=1S/C20H21NO4S/c1-4-25-20(24)16-11(2)17(12(3)22)26-19(16)21-18(23)15-10-14(15)13-8-6-5-7-9-13/h5-9,14-15H,4,10H2,1-3H3,(H,21,23) |
| InChIKey |
DDUWIOCNYVVQCA-UHFFFAOYSA-N |
| Molecular Weight |
371.451 g/mol |
| SMILES |
C1(=C(C(C)=C(S1)C(=O)C)C(=O)OCC)NC(C1C(C2=CC=CC=C2)C1)=O |
![5-Acetyl-4-methyl-2-[(2-phenyl-cyclopropanecarbonyl)-amino]-thiophene-3-carboxylic acid ethyl ester](/api/spectrum/1NZ2Vm59gfb/structure.png?h=300&w=458 "5-Acetyl-4-methyl-2-[(2-phenyl-cyclopropanecarbonyl)-amino]-thiophene-3-carboxylic acid ethyl ester")
