| SpectraBase Spectrum ID |
BeGKiH5QumC |
| Name |
4-(3-Methyl-[1,2,5]diazathiol-4-ylcarbonyl)-2-(4-fluorophenyl)-5-methyl-3-hydroxypyrazole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.058674945 u |
| Formula |
C14H11FN4O2S |
| InChI |
InChI=1S/C14H11FN4O2S/c1-7-11(12(20)13-8(2)16-18-22-13)14(21)19(17-7)10-5-3-9(15)4-6-10/h3-6,21H,1-2H3 |
| InChIKey |
YOFCBLALBBGTHS-UHFFFAOYSA-N |
| Molecular Weight |
318.326 g/mol |
| SMILES |
C1(=C(N(C=2C=CC(=CC2)F)N=C1C)O)C(C1=C(N=NS1)C)=O |
![4-(3-Methyl-[1,2,5]diazathiol-4-ylcarbonyl)-2-(4-fluorophenyl)-5-methyl-3-hydroxypyrazole](/api/spectrum/BeGKiH5QumC/structure.png?h=300&w=458 "4-(3-Methyl-[1,2,5]diazathiol-4-ylcarbonyl)-2-(4-fluorophenyl)-5-methyl-3-hydroxypyrazole")
