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3-[(p-chlorobenzyl)thio]-4-methyl-5-[2-(2-thienyl)-4-thiazolyl]-4H-1,2,4-triazole
SpectraBase Compound ID 9bqNzlTxs5Y
InChI InChI=1S/C17H13ClN4S3/c1-22-15(13-10-24-16(19-13)14-3-2-8-23-14)20-21-17(22)25-9-11-4-6-12(18)7-5-11/h2-8,10H,9H2,1H3
InChIKey RVKMWDREBOSOKK-UHFFFAOYSA-N
Mol Weight 404.95 g/mol
Molecular Formula C17H13ClN4S3
Exact Mass 403.999088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tAP0ccNYi0
Name 3-[(p-CHLOROBENZYL)THIO]-4-METHYL-5-[2-(2-THIENYL)-4-THIAZOLYL]-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 C17H13ClN4S3
InChI InChI=1S/C17H13ClN4S3/c1-22-15(13-10-24-16(19-13)14-3-2-8-23-14)20-21-17(22)25-9-11-4-6-12(18)7-5-11/h2-8,10H,9H2,1H3
InChIKey RVKMWDREBOSOKK-UHFFFAOYSA-N
Melting Point 116-118C
Molecular Weight 404.97
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms TRIAZOLE, 4H-1,2,4-, 3-//P-CHLOROBENZYL/THIO/-4-METHYL-5-/2-/2-THIENYL/- 4-THIAZOLYL/-,