SpectraBase Spectrum ID |
J4XCfj0XeYC |
Name |
Ethyl 2-[(4-methoxybenzoyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
395.119129330 u |
Formula |
C22H21NO4S |
InChI |
InChI=1S/C22H21NO4S/c1-4-27-22(25)19-18(15-8-6-5-7-9-15)14(2)28-21(19)23-20(24)16-10-12-17(26-3)13-11-16/h5-13H,4H2,1-3H3,(H,23,24) |
InChIKey |
ZAZFGVCKTKEXLY-UHFFFAOYSA-N |
Molecular Weight |
395.473 g/mol |
SMILES |
N(C1=C(C(=C(C)S1)C=1C=CC=CC1)C(=O)OCC)C(C=1C=CC(=CC1)OC)=O |