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2-[(1-mesityltetrazol-5-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide
SpectraBase Compound ID 531rkizHeFd
InChI InChI=1S/C19H18F3N5O2S/c1-11-8-12(2)17(13(3)9-11)27-18(24-25-26-27)30-10-16(28)23-14-4-6-15(7-5-14)29-19(20,21)22/h4-9H,10H2,1-3H3,(H,23,28)
InChIKey SZPJIMIRLPRJTM-UHFFFAOYSA-N
Mol Weight 437.44 g/mol
Molecular Formula C19H18F3N5O2S
Exact Mass 437.113331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8MY1CdJky5
Name 2-[(1-mesityltetrazol-5-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide
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Formula C19H18F3N5O2S
InChI InChI=1S/C19H18F3N5O2S/c1-11-8-12(2)17(13(3)9-11)27-18(24-25-26-27)30-10-16(28)23-14-4-6-15(7-5-14)29-19(20,21)22/h4-9H,10H2,1-3H3,(H,23,28)
InChIKey SZPJIMIRLPRJTM-UHFFFAOYSA-N
Molecular Weight 437.441 g/mol
SMILES N(C(CSc1[n](nnn1)-c1c(cc(cc1C)C)C)=O)c1ccc(OC(F)(F)F)cc1
SPLASH splash10-08fr-1910000000-aadfbafe8594f8aa6b0b
Synonyms N-[4-(trifluoromethoxy)phenyl]-2-[1-(2,4,6-trimethylphenyl)tetrazol-5-yl]sulfanyl-acetamide N-[4-(trifluoromethoxy)phenyl]-2-[[1-(2,4,6-trimethylphenyl)-5-tetrazolyl]thio]acetamide N-[4-(trifluoromethyloxy)phenyl]-2-[[1-(2,4,6-trimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide
Wiley ID 1457835