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4-(3-Chlorophenyl)-3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1H-1,2,4-triazole-5(4H)-thione

View entire compound with spectra: 1 MS (GC)

4-(3-Chlorophenyl)-3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1H-1,2,4-triazole-5(4H)-thione
SpectraBase Compound ID B2JzyWNVrFE
InChI InChI=1S/C17H13ClN6S/c1-11-15(19-22-24(11)13-7-3-2-4-8-13)16-20-21-17(25)23(16)14-9-5-6-12(18)10-14/h2-10H,1H3,(H,21,25)
InChIKey PUJCLQQYIOYQGC-UHFFFAOYSA-N
Mol Weight 368.85 g/mol
Molecular Formula C17H13ClN6S
Exact Mass 368.061093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4luw49xGP8g
Name 4-(3-Chlorophenyl)-3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1H-1,2,4-triazole-5(4H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClN6S
InChI InChI=1S/C17H13ClN6S/c1-11-15(19-22-24(11)13-7-3-2-4-8-13)16-20-21-17(25)23(16)14-9-5-6-12(18)10-14/h2-10H,1H3,(H,21,25)
InChIKey PUJCLQQYIOYQGC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100022
Molecular Weight 368.846 g/mol
SMILES N1N=C(N(C1=S)c1cccc(c1)Cl)c1c([n](nn1)-c1ccccc1)C
SPLASH splash10-014i-0229000000-0a2cddf4fd3c7f3c3d9d
Source of Spectrum QA-48-124-3d
Synonyms 4-(3-Chlorophenyl)-5-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Wiley ID 1795273