| SpectraBase Spectrum ID |
8IrLojZdmPd |
| Name |
2-{[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetyl]amino}-N-isopropylbenzamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.104541893 u |
| Formula |
C19H19N3O5S |
| InChI |
InChI=1S/C19H19N3O5S/c1-12(2)20-18(24)13-7-3-5-9-15(13)21-17(23)11-22-19(25)14-8-4-6-10-16(14)28(22,26)27/h3-10,12H,11H2,1-2H3,(H,20,24)(H,21,23) |
| InChIKey |
OERCVGTUYMYTIS-UHFFFAOYSA-N |
| Molecular Weight |
401.437 g/mol |
| SMILES |
N(C(C=1C(=CC=CC1)NC(CN1S(C=2C(=CC=CC2)C1=O)(=O)=O)=O)=O)C(C)C |
![2-{[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetyl]amino}-N-isopropylbenzamide](/api/spectrum/8IrLojZdmPd/structure.png?h=300&w=458 "2-{[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetyl]amino}-N-isopropylbenzamide")
