| SpectraBase Spectrum ID |
8m25MG53cqI |
| Name |
5-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(methylsulfanyl)phenyl]-2-furamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.030311004 u |
| Formula |
C18H18BrN3O2S |
| InChI |
InChI=1S/C18H18BrN3O2S/c1-11-17(19)12(2)22(21-11)10-13-8-9-15(24-13)18(23)20-14-6-4-5-7-16(14)25-3/h4-9H,10H2,1-3H3,(H,20,23) |
| InChIKey |
OPMUGBPSBNFAPZ-UHFFFAOYSA-N |
| Molecular Weight |
420.325 g/mol |
| SMILES |
N(C=1C(SC)=CC=CC1)C(C=1OC(CN2N=C(C)C(=C2C)Br)=CC1)=O |
![5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(methylsulfanyl)phenyl]-2-furamide](/api/spectrum/8m25MG53cqI/structure.png?h=300&w=458 "5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(methylsulfanyl)phenyl]-2-furamide")
