| SpectraBase Spectrum ID |
2Ek2LGxnN2i |
| Name |
4-Keto-N-[2-(4-methoxyphenyl)ethyl]-1H-[1,2,4]triazino[4,3-A]benzimidazole-3-carboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.133139424 u |
| Formula |
C19H17N5O3 |
| InChI |
InChI=1S/C19H17N5O3/c1-27-13-8-6-12(7-9-13)10-11-20-17(25)16-18(26)24-15-5-3-2-4-14(15)21-19(24)23-22-16/h2-9H,10-11H2,1H3,(H,20,25)(H,21,23) |
| InChIKey |
MAKQWLBFFSLSFE-UHFFFAOYSA-N |
| Molecular Weight |
363.377 g/mol |
| SMILES |
C1=2N(C(C(=NN2)C(=O)NCCC=2C=CC(=CC2)OC)=O)C=2C(N1)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840193 |
![4-keto-N-[2-(4-methoxyphenyl)ethyl]-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide](/api/spectrum/2Ek2LGxnN2i/structure.png?h=300&w=458 "4-keto-N-[2-(4-methoxyphenyl)ethyl]-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide")
