| SpectraBase Spectrum ID |
KEOHjjT9aKB |
| Name |
Acetamide, 2-[4-[1-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-B]pyridin-4-yl]phenoxy]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.159688525 u |
| Formula |
C22H20N6O3 |
| InChI |
InChI=1S/C22H20N6O3/c1-12-20-15(13-6-8-14(9-7-13)31-11-18(23)29)10-19(30)26-21(20)28(27-12)22-24-16-4-2-3-5-17(16)25-22/h2-9,15H,10-11H2,1H3,(H2,23,29)(H,24,25)(H,26,30) |
| InChIKey |
WRDWWCHBJJQVRR-UHFFFAOYSA-N |
| Molecular Weight |
416.441 g/mol |
| SMILES |
N1C(N2C3=C(C(=N2)C)C(C2=CC=C(C=C2)OCC(N)=O)CC(=O)N3)=NC2=C1C=CC=C2 |
![acetamide, 2-[4-[1-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy]-](/api/spectrum/KEOHjjT9aKB/structure.png?h=300&w=458 "acetamide, 2-[4-[1-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy]-")
