SpectraBase Spectrum ID |
BdUmkWirzu6 |
Name |
Benzenepropanamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-alpha-[(2-thienylsulfonyl)amino]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
444.081364095 u |
Formula |
C21H20N2O5S2 |
InChI |
InChI=1S/C21H20N2O5S2/c24-21(22-16-8-9-18-19(14-16)28-11-10-27-18)17(13-15-5-2-1-3-6-15)23-30(25,26)20-7-4-12-29-20/h1-9,12,14,17,23H,10-11,13H2,(H,22,24) |
InChIKey |
NOPDXLKFMYHSFF-UHFFFAOYSA-N |
Molecular Weight |
444.520 g/mol |
SMILES |
N(S(C=1SC=CC1)(=O)=O)C(C(NC1=CC=2OCCOC2C=C1)=O)CC=1C=CC=CC1 |