SpectraBase Spectrum ID |
J8qEjW06eg9 |
Name |
2,6-Di-tert-butyl-4-[5-(pyridin-4-yl)-3-sulfanyl-4H-1,2,4-triazole-4-ylimino]cyclohexa-2,5-dienone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H25N5OS |
InChI |
InChI=1S/C21H25N5OS/c1-20(2,3)15-11-14(12-16(17(15)27)21(4,5)6)25-26-18(23-24-19(26)28)13-7-9-22-10-8-13/h7-12H,1-6H3,(H,24,28) |
InChIKey |
NSVWCJOSZAKPKY-UHFFFAOYSA-N |
Molecular Weight |
395.525 g/mol |
SMILES |
Sc1[n](c(nn1)-c1ccncc1)N=C1C=C(C(C)(C)C)C(C(=C1)C(C)(C)C)=O |
SPLASH |
splash10-000j-1219000000-54ae5a37cd84f5649517 |
Source of Spectrum |
O1-45-142-3a |
Wiley ID |
1668991 |