SpectraBase Spectrum ID |
L0egch6kGOk |
Name |
Benzaldehyde {1,3-dimethyl-2,6-dioxo-7-[(2E)-3-phenyl-2-propenyl]-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
414.180423970 u |
Formula |
C23H22N6O2 |
InChI |
InChI=1S/C23H22N6O2/c1-27-20-19(21(30)28(2)23(27)31)29(15-9-14-17-10-5-3-6-11-17)22(25-20)26-24-16-18-12-7-4-8-13-18/h3-14,16H,15H2,1-2H3,(H,25,26)/b14-9+,24-16+ |
InChIKey |
BHVCAUHAJOBASN-UBXJNSBZSA-N |
Molecular Weight |
414.469 g/mol |
SMILES |
N(C1=NC2=C(C(=O)N(C(N2C)=O)C)N1C\C=C\C=1C=CC=CC1)\N=C\C1=CC=CC=C1 |