SpectraBase Spectrum ID |
4WE1tDyyPtL |
Name |
Benzamide, 3,4,5-trimethoxy-N-[3-[2-[(1-oxopropyl)amino]-4-thiazolyl]phenyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
441.135842022 u |
Formula |
C22H23N3O5S |
InChI |
InChI=1S/C22H23N3O5S/c1-5-19(26)25-22-24-16(12-31-22)13-7-6-8-15(9-13)23-21(27)14-10-17(28-2)20(30-4)18(11-14)29-3/h6-12H,5H2,1-4H3,(H,23,27)(H,24,25,26) |
InChIKey |
LGPPLGRYNIDWFQ-UHFFFAOYSA-N |
Molecular Weight |
441.502 g/mol |
SMILES |
N(C(C=1C=C(OC)C(=C(C1)OC)OC)=O)C=1C=C(C=2N=C(SC2)NC(=O)CC)C=CC1 |