| SpectraBase Spectrum ID |
HZHBLavHBDx |
| Name |
Methyl 2-[(4-tert-butylbenzoyl)amino]-5-[(dimethylamino)carbonyl]-4-methyl-3-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.161328495 u |
| Formula |
C21H26N2O4S |
| InChI |
InChI=1S/C21H26N2O4S/c1-12-15(20(26)27-7)18(28-16(12)19(25)23(5)6)22-17(24)13-8-10-14(11-9-13)21(2,3)4/h8-11H,1-7H3,(H,22,24) |
| InChIKey |
KSFVBQUYZGZCGT-UHFFFAOYSA-N |
| Molecular Weight |
402.509 g/mol |
| SMILES |
N(C1=C(C(C)=C(S1)C(N(C)C)=O)C(=O)OC)C(C=1C=CC(C(C)(C)C)=CC1)=O |
![Methyl 2-[(4-tert-butylbenzoyl)amino]-5-[(dimethylamino)carbonyl]-4-methyl-3-thiophenecarboxylate](/api/spectrum/HZHBLavHBDx/structure.png?h=300&w=458 "Methyl 2-[(4-tert-butylbenzoyl)amino]-5-[(dimethylamino)carbonyl]-4-methyl-3-thiophenecarboxylate")
