SpectraBase Spectrum ID |
F89AU2iYUOT |
Name |
Acetamide, 2-[[(4-bromophenyl)sulfonyl](phenylmethyl)amino]-N-(4-pyridinylmethyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
473.040875687 u |
Formula |
C21H20BrN3O3S |
InChI |
InChI=1S/C21H20BrN3O3S/c22-19-6-8-20(9-7-19)29(27,28)25(15-18-4-2-1-3-5-18)16-21(26)24-14-17-10-12-23-13-11-17/h1-13H,14-16H2,(H,24,26) |
InChIKey |
SIMWVJMIHSZTKC-UHFFFAOYSA-N |
Molecular Weight |
474.373 g/mol |
SMILES |
N(C(CN(S(C1=CC=C(C=C1)Br)(=O)=O)CC=1C=CC=CC1)=O)CC1=CC=NC=C1 |