SpectraBase Spectrum ID |
BMDkeeupF5Q |
Name |
5-(2-Chlorophenyl)-4-{[(E)-(5-methyl-2-furyl)methylidene]amino}-4H-1,2,4-triazol-3-yl hydrosulfide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
318.034209863 u |
Formula |
C14H11ClN4OS |
InChI |
InChI=1S/C14H11ClN4OS/c1-9-6-7-10(20-9)8-16-19-13(17-18-14(19)21)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,18,21)/b16-8+ |
InChIKey |
VLXWCASCVKMQMO-LZYBPNLTSA-N |
Molecular Weight |
318.782 g/mol |
SMILES |
SC=1N(C(=NN1)C1=C(Cl)C=CC=C1)\N=C\C=1OC(C)=CC1 |