| SpectraBase Spectrum ID |
5nxLnsAHdUi |
| Name |
3-Butyl-6-phenethyl-4-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-1,2,4-triazin-5-one |
| Alternate Name(s) |
3-Butyl-6-(2-phenylethyl)-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazin-5-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H29N7O |
| InChI |
InChI=1S/C29H29N7O/c1-2-3-13-27-31-30-26(19-16-21-9-5-4-6-10-21)29(37)36(27)20-22-14-17-23(18-15-22)24-11-7-8-12-25(24)28-32-34-35-33-28/h4-12,14-15,17-18H,2-3,13,16,19-20H2,1H3,(H,32,33,34,35) |
| InChIKey |
IQCSUVBCALWDBG-UHFFFAOYSA-N |
| Molecular Weight |
491.599 g/mol |
| SMILES |
[nH]1c(nnn1)-c1c(-c2ccc(CN3C(C(CCc4ccccc4)=NN=C3CCCC)=O)cc2)cccc1 |
| SPLASH |
splash10-0a4i-0090200000-5e29e35b35cae813119c |
| Source of Spectrum |
QA-46-58-18 |
| Wiley ID |
863094 |
![3-Butyl-6-phenethyl-4-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-1,2,4-triazin-5-one](/api/spectrum/5nxLnsAHdUi/structure.png?h=300&w=458 "3-Butyl-6-phenethyl-4-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-1,2,4-triazin-5-one")
