SpectraBase Spectrum ID |
D5knKmIZXT2 |
Name |
7-Methyl-1-phenyl-3-(thiophene-2-carbonyl)-1H-[1,2,4]triazino[4,3-b][1,2,4,5]tetrazin-6(4H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H12N6O2S |
InChI |
InChI=1S/C16H12N6O2S/c1-10-15(24)22-16(18-17-10)21(11-6-3-2-4-7-11)19-14(20-22)13(23)12-8-5-9-25-12/h2-9H,1H3,(H,19,20) |
InChIKey |
HXHZRRLQIRFZAA-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002_(SICI)1521-3897(200001)342_1_96 |
Molecular Weight |
352.372 g/mol |
SMILES |
N1C(=NN(C2=NN=C(C(N12)=O)C)c1ccccc1)C(=O)c1sccc1 |
SPLASH |
splash10-03di-1904000000-147569267f9ccc89347c |
Source of Spectrum |
JF-342-98-9m |
Wiley ID |
1766888 |