SpectraBase Spectrum ID |
BuekJFfA5F9 |
Name |
Benzenepropanamide, N-(4-ethylphenyl)-alpha-[(2-thienylsulfonyl)amino]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
414.107184921 u |
Formula |
C21H22N2O3S2 |
InChI |
InChI=1S/C21H22N2O3S2/c1-2-16-10-12-18(13-11-16)22-21(24)19(15-17-7-4-3-5-8-17)23-28(25,26)20-9-6-14-27-20/h3-14,19,23H,2,15H2,1H3,(H,22,24) |
InChIKey |
LBXFXXBEIQZREZ-UHFFFAOYSA-N |
Molecular Weight |
414.538 g/mol |
SMILES |
N(S(C=1SC=CC1)(=O)=O)C(C(NC1=CC=C(C=C1)CC)=O)CC1=CC=CC=C1 |