| SpectraBase Spectrum ID |
2G6zqbjsES |
| Name |
4'-{[5-(2-Butyl-3-(2-ethylphenyl))-2,1,3,4-1H-thiatriazol-2-on-1-yl]methyl}biphenyl-2-tetrazole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H29N7OS |
| InChI |
InChI=1S/C27H29N7OS/c1-3-5-14-26-30-34(25-13-9-6-10-21(25)4-2)36(35)33(26)19-20-15-17-22(18-16-20)23-11-7-8-12-24(23)27-28-31-32-29-27/h6-13,15-18H,3-5,14,19H2,1-2H3,(H,28,29,31,32) |
| InChIKey |
IDMYOYGYJVXZDZ-UHFFFAOYSA-N |
| Molecular Weight |
499.637 g/mol |
| SMILES |
[nH]1c(nnn1)-c1c(-c2ccc(CN3S(N(N=C3CCCC)c3c(CC)cccc3)=O)cc2)cccc1 |
| SPLASH |
splash10-000i-0098300000-5c620d3faf63d0ac1d63 |
| Source of Spectrum |
QA-43-91-62 |
| Wiley ID |
862133 |
![4'-{[5-(2-Butyl-3-(2-ethylphenyl))-2,1,3,4-1H-thiatriazol-2-on-1-yl]methyl}biphenyl-2-tetrazole](/api/spectrum/2G6zqbjsES/structure.png?h=300&w=458 "4'-{[5-(2-Butyl-3-(2-ethylphenyl))-2,1,3,4-1H-thiatriazol-2-on-1-yl]methyl}biphenyl-2-tetrazole")
