SpectraBase Spectrum ID |
BbqG7WkBp0C |
Name |
Benzenepropanamide, N-(4-bromophenyl)-alpha-[(2-thienylsulfonyl)amino]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
463.986397760 u |
Formula |
C19H17BrN2O3S2 |
InChI |
InChI=1S/C19H17BrN2O3S2/c20-15-8-10-16(11-9-15)21-19(23)17(13-14-5-2-1-3-6-14)22-27(24,25)18-7-4-12-26-18/h1-12,17,22H,13H2,(H,21,23) |
InChIKey |
FWORAFBSXVOKDY-UHFFFAOYSA-N |
Molecular Weight |
465.380 g/mol |
SMILES |
N(S(C=1SC=CC1)(=O)=O)C(C(NC1=CC=C(C=C1)Br)=O)CC1=CC=CC=C1 |