SpectraBase Spectrum ID |
2ZnKCgb64Rb |
Name |
2-((E)-{[3-(2-pyridinyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
297.068431167 u |
Formula |
C14H11N5OS |
InChI |
InChI=1S/C14H11N5OS/c20-12-7-2-1-5-10(12)9-16-19-13(17-18-14(19)21)11-6-3-4-8-15-11/h1-9,20H,(H,18,21)/b16-9+ |
InChIKey |
OXKNAHCVOLARDW-CXUHLZMHSA-N |
Molecular Weight |
297.336 g/mol |
SMILES |
SC1=NN=C(N1\N=C\C=1C(=CC=CC1)O)C=1N=CC=CC1 |