SpectraBase Spectrum ID |
CsNa6wsC6hg |
Name |
N-[1-[[3-(1-Hydroxypropyl)phenyl]aminocarbonyl]-2-phenylethyl]-4-methylbenzenesulfonamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.176978560 u |
Formula |
C25H28N2O4S |
InChI |
InChI=1S/C25H28N2O4S/c1-3-24(28)20-10-7-11-21(17-20)26-25(29)23(16-19-8-5-4-6-9-19)27-32(30,31)22-14-12-18(2)13-15-22/h4-15,17,23-24,27-28H,3,16H2,1-2H3,(H,26,29) |
InChIKey |
RNICIPBUQLPOOY-UHFFFAOYSA-N |
Molecular Weight |
452.569 g/mol |
SMILES |
C1(CC(NS(C=2C=CC(C)=CC2)(=O)=O)C(=O)NC2=CC(C(CC)O)=CC=C2)=CC=CC=C1 |