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N-{4-[(1E)-1-(2-{5-[(E)-(4-Fluorophenyl)diazenyl]-4-methyl-1,3-thiazol-2-yl}hydrazinylidene)ethyl]phenyl}-4-methylbenzenesulfonamide
SpectraBase Compound ID 9FEZ49M0fFJ
InChI InChI=1S/C25H23FN6O2S2/c1-16-4-14-23(15-5-16)36(33,34)32-22-10-6-19(7-11-22)17(2)28-31-25-27-18(3)24(35-25)30-29-21-12-8-20(26)9-13-21/h4-15,32H,1-3H3,(H,27,31)/b28-17+,30-29+
InChIKey LJLLSLNYOCCEEJ-UMJYARSTSA-N
Mol Weight 522.62 g/mol
Molecular Formula C25H23FN6O2S2
Exact Mass 522.130795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQVHsMFDCea
Name N-{4-[(1E)-1-(2-{5-[(E)-(4-Fluorophenyl)diazenyl]-4-methyl-1,3-thiazol-2-yl}hydrazinylidene)ethyl]phenyl}-4-methylbenzenesulfonamide
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Formula C25H23FN6O2S2
InChI InChI=1S/C25H23FN6O2S2/c1-16-4-14-23(15-5-16)36(33,34)32-22-10-6-19(7-11-22)17(2)28-31-25-27-18(3)24(35-25)30-29-21-12-8-20(26)9-13-21/h4-15,32H,1-3H3,(H,27,31)/b28-17+,30-29+
InChIKey LJLLSLNYOCCEEJ-UMJYARSTSA-N
Literature Reference DOI 10.1002/cbdv.201800231
Molecular Weight 522.617 g/mol
SMILES N(c1sc(\N=N\c2ccc(F)cc2)c(n1)C)\N=C\(c1ccc(cc1)NS(=O)(=O)c1ccc(C)cc1)C
SPLASH splash10-0076-9250050000-0789c27a19d916633299
Source of Spectrum CBD-15-11-6i
Synonyms N-(4-((E)-1-(2-(5-((E)-(4-fluorophenyl)diazenyl)-4-methylthiazol-2-yl)hydrazineylidene)ethyl)phenyl)-4-methylbenzenesulfonamide
Wiley ID 1813238