| SpectraBase Spectrum ID |
HzrOkznniQw |
| Name |
3-({[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.050063966 u |
| Formula |
C17H16N2O5S2 |
| InChI |
InChI=1S/C17H16N2O5S2/c1-26(23,24)10-4-5-11-12(7-10)25-17(18-11)19-15(20)13-8-2-3-9(6-8)14(13)16(21)22/h2-5,7-9,13-14H,6H2,1H3,(H,21,22)(H,18,19,20) |
| InChIKey |
VCXQHHJYPXWYIK-UHFFFAOYSA-N |
| Molecular Weight |
392.444 g/mol |
| SMILES |
N(C(C1C2C=CC(C1C(=O)O)C2)=O)C1=NC=2C=CC(S(=O)(=O)C)=CC2S1 |
![3-({[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid](/api/spectrum/HzrOkznniQw/structure.png?h=300&w=458 "3-({[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid")
