| SpectraBase Spectrum ID |
8Ejahm0EXGZ |
| Name |
Methyl 2-[(2,3-dimethoxybenzoyl)amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.104622080 u |
| Formula |
C22H20FNO5S |
| InChI |
InChI=1S/C22H20FNO5S/c1-12-17(13-8-10-14(23)11-9-13)18(22(26)29-4)21(30-12)24-20(25)15-6-5-7-16(27-2)19(15)28-3/h5-11H,1-4H3,(H,24,25) |
| InChIKey |
ZMMUBFJFEZITOW-UHFFFAOYSA-N |
| Molecular Weight |
429.462 g/mol |
| SMILES |
N(C1=C(C(=C(C)S1)C=1C=CC(=CC1)F)C(=O)OC)C(C=1C(=C(OC)C=CC1)OC)=O |
![Methyl 2-[(2,3-dimethoxybenzoyl)amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate](/api/spectrum/8Ejahm0EXGZ/structure.png?h=300&w=458 "Methyl 2-[(2,3-dimethoxybenzoyl)amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate")
