SpectraBase Spectrum ID |
8lYz1cWxXYf |
Name |
[4-amino-5-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-ylazo)-6-piperidin-1-yl-pyrimidin-2-yl]-acetonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H25N9O |
InChI |
InChI=1S/C22H25N9O/c1-15-18(22(32)31(29(15)2)16-9-5-3-6-10-16)27-28-19-20(24)25-17(11-12-23)26-21(19)30-13-7-4-8-14-30/h3,5-6,9-10H,4,7-8,11,13-14H2,1-2H3,(H2,24,25,26)/b28-27+ |
InChIKey |
VDNMEEVAFGFWMQ-BYYHNAKLSA-N |
Molecular Weight |
431.504 g/mol |
SMILES |
Nc1nc(nc(c1\N=N\C=1C(N(N(C1C)C)c1ccccc1)=O)N1CCCCC1)CC#N |
SPLASH |
splash10-0aei-9421000000-65b9a6f8464c670cd3cb |
Source of Spectrum |
Y-49-779-16 |
Wiley ID |
1716745 |