| SpectraBase Spectrum ID |
H1Tx2Y3JTM |
| Name |
1-{4-[(4-Bromo-1H-pyrazol-1-yl)sulfonyl]phenyl}-2-pyrrolidinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.978275429 u |
| Formula |
C13H12BrN3O3S |
| InChI |
InChI=1S/C13H12BrN3O3S/c14-10-8-15-17(9-10)21(19,20)12-5-3-11(4-6-12)16-7-1-2-13(16)18/h3-6,8-9H,1-2,7H2 |
| InChIKey |
YWKHWMHQODYMGD-UHFFFAOYSA-N |
| Molecular Weight |
370.221 g/mol |
| SMILES |
C1CN(C2=CC=C(S(N3C=C(Br)C=N3)(=O)=O)C=C2)C(=O)C1 |
![1-{4-[(4-bromo-1H-pyrazol-1-yl)sulfonyl]phenyl}-2-pyrrolidinone](/api/spectrum/H1Tx2Y3JTM/structure.png?h=300&w=458 "1-{4-[(4-bromo-1H-pyrazol-1-yl)sulfonyl]phenyl}-2-pyrrolidinone")
