SpectraBase Spectrum ID |
E5aGigiRo0c |
Name |
4-Cyano-6-(n-octylamino)-2,7-diphenyl-pyrimido[5,4-c]pyridazine-3,8-dione |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H28N6O2 |
InChI |
InChI=1S/C27H28N6O2/c1-2-3-4-5-6-13-18-29-27-30-23-22(19-28)25(34)33(21-16-11-8-12-17-21)31-24(23)26(35)32(27)20-14-9-7-10-15-20/h7-12,14-17H,2-6,13,18H2,1H3,(H,29,30) |
InChIKey |
HIHZHODXVGDMAP-UHFFFAOYSA-N |
Molecular Weight |
468.561 g/mol |
SMILES |
N(C=1N(C(C=2C(=C(C#N)C(N(N2)c2ccccc2)=O)N1)=O)c1ccccc1)CCCCCCCC |
SPLASH |
splash10-014i-0000900000-6482402a1099e1200474 |
Source of Spectrum |
Y-49-391-5d |
Wiley ID |
1706540 |