SpectraBase Spectrum ID |
FWXOwDE31ne |
Name |
5-(3-Chlorophenyl)-4-{[(E)-(4-isopropylphenyl)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 |
356.086245437 u |
Formula |
C18H17ClN4S |
InChI |
InChI=1S/C18H17ClN4S/c1-12(2)14-8-6-13(7-9-14)11-20-23-17(21-22-18(23)24)15-4-3-5-16(19)10-15/h3-12H,1-2H3,(H,22,24)/b20-11+ |
InChIKey |
KGAFMKOOYKXLGT-RGVLZGJSSA-N |
Molecular Weight |
356.875 g/mol |
SMILES |
SC=1N(C(=NN1)C1=CC(Cl)=CC=C1)\N=C\C=1C=CC(=CC1)C(C)C |