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4'-chloro-2-{[4-methyl-5-(3-thenyl)-4H-1,2,4-triazol-3-yl]thio}acetanilide
SpectraBase Compound ID 3BEjyq4JASD
InChI InChI=1S/C16H15ClN4OS2/c1-21-14(8-11-6-7-23-9-11)19-20-16(21)24-10-15(22)18-13-4-2-12(17)3-5-13/h2-7,9H,8,10H2,1H3,(H,18,22)
InChIKey IRBCFSKQKDNGNZ-UHFFFAOYSA-N
Mol Weight 378.9 g/mol
Molecular Formula C16H15ClN4OS2
Exact Mass 378.037581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5AYicZwqHXs
Name 4'-CHLORO-2-{[4-METHYL-5-(3-THENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETANILIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClN4OS2
InChI InChI=1S/C16H15ClN4OS2/c1-21-14(8-11-6-7-23-9-11)19-20-16(21)24-10-15(22)18-13-4-2-12(17)3-5-13/h2-7,9H,8,10H2,1H3,(H,18,22)
InChIKey IRBCFSKQKDNGNZ-UHFFFAOYSA-N
Melting Point 156-158C
Molecular Weight 378.91
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ACETANILIDE, 4'-CHLORO-2-{[4-METHYL-5-(3-THENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}-,