SpectraBase Spectrum ID |
4aAVGndMTXi |
Name |
1-{[(2,5-dimethoxy-4-nitrophenyl)thio]acetyl}-2-(3,4,5-trimethoxybenzoyl)hydrazine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
481.115500498 u |
Formula |
C20H23N3O9S |
InChI |
InChI=1S/C20H23N3O9S/c1-28-13-9-17(14(29-2)8-12(13)23(26)27)33-10-18(24)21-22-20(25)11-6-15(30-3)19(32-5)16(7-11)31-4/h6-9H,10H2,1-5H3,(H,21,24)(H,22,25) |
InChIKey |
PSFUHQHZKIBVSP-UHFFFAOYSA-N |
Molecular Weight |
481.476 g/mol |
SMILES |
N(C(C1=CC(=C(C(=C1)OC)OC)OC)=O)NC(=O)CSC=1C=C(C(=CC1OC)N(=O)=O)OC |