SpectraBase Spectrum ID |
3QUtjZIzE1i |
Name |
6-(4-(4-Chlorophenyl)-4,5-dihydro-5-imino-1,3,4-thiadiazol-2-yl)-2-hydroxy-4-p-tolylpyridine-3-carbonitrile |
Appearance |
Brown solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H14ClN5OS |
InChI |
InChI=1S/C21H14ClN5OS/c1-12-2-4-13(5-3-12)16-10-18(25-19(28)17(16)11-23)20-26-27(21(24)29-20)15-8-6-14(22)7-9-15/h2-10,24H,1H3,(H,25,28) |
InChIKey |
MXEYQEVFCLKCPO-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GCMS-QP1000 EX |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.3088 |
Molecular Weight |
419.890 g/mol |
SMILES |
Oc1c(c(cc(C2=NN(C(S2)=N)c2ccc(cc2)Cl)n1)-c1ccc(cc1)C)C#N |
SPLASH |
splash10-060c-9551000000-e5c6bdfdf8b4f1ed9af9 |
Source of Spectrum |
Y-55-534-6b |
Wiley ID |
1879036 |