| SpectraBase Spectrum ID |
IRnooZHdHRb |
| Name |
N-(2-Fluorophenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-D]pyrimidin-4-yl]sulfanyl}acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.105959491 u |
| Formula |
C20H16FN5OS |
| InChI |
InChI=1S/C20H16FN5OS/c1-13-6-8-14(9-7-13)26-19-15(10-24-26)20(23-12-22-19)28-11-18(27)25-17-5-3-2-4-16(17)21/h2-10,12H,11H2,1H3,(H,25,27) |
| InChIKey |
CKQKLHZQSMOTJX-UHFFFAOYSA-N |
| Molecular Weight |
393.440 g/mol |
| SMILES |
N(C(CSC=1C2=C(N(N=C2)C2=CC=C(C=C2)C)N=CN1)=O)C1=C(F)C=CC=C1 |
![N-(2-fluorophenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide](/api/spectrum/IRnooZHdHRb/structure.png?h=300&w=458 "N-(2-fluorophenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide")
