SpectraBase Spectrum ID |
DDGxpfd1ZyI |
Name |
Acetamide, N-(3-bromophenyl)-2-[[(4-methoxyphenyl)sulfonyl](2-phenylethyl)amino]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
502.056191399 u |
Formula |
C23H23BrN2O4S |
InChI |
InChI=1S/C23H23BrN2O4S/c1-30-21-10-12-22(13-11-21)31(28,29)26(15-14-18-6-3-2-4-7-18)17-23(27)25-20-9-5-8-19(24)16-20/h2-13,16H,14-15,17H2,1H3,(H,25,27) |
InChIKey |
YIFSRJWQFYVYSD-UHFFFAOYSA-N |
Molecular Weight |
503.411 g/mol |
SMILES |
N(C(CN(S(C=1C=CC(=CC1)OC)(=O)=O)CCC=1C=CC=CC1)=O)C=1C=C(Br)C=CC1 |