| SpectraBase Spectrum ID |
E4p0FTWbAmB |
| Name |
3-{[(1-benzyl-1H-pyrazolo[3,4-D]pyrimidin-4-yl)sulfanyl]methyl}phenyl methyl ether |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.120132389 u |
| Formula |
C20H18N4OS |
| InChI |
InChI=1S/C20H18N4OS/c1-25-17-9-5-8-16(10-17)13-26-20-18-11-23-24(19(18)21-14-22-20)12-15-6-3-2-4-7-15/h2-11,14H,12-13H2,1H3 |
| InChIKey |
PHYBEKMRWBQCQO-UHFFFAOYSA-N |
| Molecular Weight |
362.451 g/mol |
| SMILES |
C=1C=CC(CN2C3=C(C(SCC4=CC(OC)=CC=C4)=NC=N3)C=N2)=CC1 |
![3-{[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]methyl}phenyl methyl ether](/api/spectrum/E4p0FTWbAmB/structure.png?h=300&w=458 "3-{[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]methyl}phenyl methyl ether")
