| SpectraBase Spectrum ID |
9gSNAtHfp2d |
| Name |
8-[(4-Methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-quinoline |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.078995851 u |
| Formula |
C18H13N5O2S |
| InChI |
InChI=1S/C18H13N5O2S/c1-22-17(12-6-3-2-4-7-12)20-21-18(22)26-15-10-9-14(23(24)25)13-8-5-11-19-16(13)15/h2-11H,1H3 |
| InChIKey |
SIUYBVVOMRNIJE-UHFFFAOYSA-N |
| Molecular Weight |
363.395 g/mol |
| SMILES |
C=1C=CC(C=2N(C(=NN2)SC=2C3=C(C=CC=N3)C(N(=O)=O)=CC2)C)=CC1 |
![8-[(4-Methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-quinoline](/api/spectrum/9gSNAtHfp2d/structure.png?h=300&w=458 "8-[(4-Methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-quinoline")
