SpectraBase Spectrum ID |
37KkiEcDx2b |
Name |
4-[((E)-{5-[(4-chloro-3,5-dimethylphenoxy)methyl]-2-furyl}methylidene)amino]-5-methyl-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 |
376.076074675 u |
Formula |
C17H17ClN4O2S |
InChI |
InChI=1S/C17H17ClN4O2S/c1-10-6-15(7-11(2)16(10)18)23-9-14-5-4-13(24-14)8-19-22-12(3)20-21-17(22)25/h4-8H,9H2,1-3H3,(H,21,25)/b19-8+ |
InChIKey |
BKHGKTWULKUKNA-UFWORHAWSA-N |
Molecular Weight |
376.862 g/mol |
SMILES |
SC1=NN=C(N1\N=C\C=1OC(COC=2C=C(C(=C(C2)C)Cl)C)=CC1)C |