SpectraBase Spectrum ID |
Etpl6Xw0Xx9 |
Name |
5-(4-Chlorophenoxy)-7-oxo-6-phenyl-1-p-tolyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonitrile |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H16ClN5O2 |
InChI |
InChI=1S/C25H16ClN5O2/c1-16-7-11-19(12-8-16)31-23-22(21(15-27)29-31)28-25(33-20-13-9-17(26)10-14-20)30(24(23)32)18-5-3-2-4-6-18/h2-14H,1H3 |
InChIKey |
NKZUMOAAXYOBMX-UHFFFAOYSA-N |
Instrument Name |
Finnigan trace |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0013.627 |
Molecular Weight |
453.889 g/mol |
SMILES |
C=1(N(C(c2c(N1)c(n[n]2-c1ccc(cc1)C)C#N)=O)c1ccccc1)Oc1ccc(cc1)Cl |
SPLASH |
splash10-1004-8349800000-898fafe8b5d0eab62d69 |
Source of Spectrum |
ARK-2012-301-4d |
Wiley ID |
1864674 |