SpectraBase Spectrum ID |
Fes1NTcKOoy |
Name |
Benzamide, N-(4-ethylphenyl)-2-[[2-[(phenylmethyl)thio]acetyl]amino]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.155849193 u |
Formula |
C24H24N2O2S |
InChI |
InChI=1S/C24H24N2O2S/c1-2-18-12-14-20(15-13-18)25-24(28)21-10-6-7-11-22(21)26-23(27)17-29-16-19-8-4-3-5-9-19/h3-15H,2,16-17H2,1H3,(H,25,28)(H,26,27) |
InChIKey |
LWTCUBDPAWDVRY-UHFFFAOYSA-N |
Molecular Weight |
404.528 g/mol |
SMILES |
C(C1=C(NC(=O)CSCC2=CC=CC=C2)C=CC=C1)(NC1=CC=C(CC)C=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928002 |