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3-[(o-chlorobenzyl)thio]-5-(5-chlorobenzo[b]thien-3-yl)-4-methyl-4H-1,2,4-triazole

View entire compound with spectra: 2 NMR, and 1 FTIR

3-[(o-chlorobenzyl)thio]-5-(5-chlorobenzo[b]thien-3-yl)-4-methyl-4H-1,2,4-triazole
SpectraBase Compound ID I5R6sIdXNny
InChI InChI=1S/C18H13Cl2N3S2/c1-23-17(14-10-24-16-7-6-12(19)8-13(14)16)21-22-18(23)25-9-11-4-2-3-5-15(11)20/h2-8,10H,9H2,1H3
InChIKey NAGZSZIFLIESKZ-UHFFFAOYSA-N
Mol Weight 406.35 g/mol
Molecular Formula C18H13Cl2N3S2
Exact Mass 404.992795 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KwPa2v8SLX1
Name 3-[(o-CHLOROBENZYL)THIO]-5-(5-CHLOROBENZO[b]THIEN-3-YL)-4-METHYL-4H-1,2,4-TRIAZOLE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13Cl2N3S2
InChI InChI=1S/C18H13Cl2N3S2/c1-23-17(14-10-24-16-7-6-12(19)8-13(14)16)21-22-18(23)25-9-11-4-2-3-5-15(11)20/h2-8,10H,9H2,1H3
InChIKey NAGZSZIFLIESKZ-UHFFFAOYSA-N
Melting Point 163-165C
Molecular Weight 406.36
Technique KBr WAFER