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3-Bromanyl-N-(3-methylpent-1-yn-3-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID 9DKEVHejjgv
InChI InChI=1S/C18H14BrF3N4OS/c1-4-17(3,5-2)24-16(27)14-13(19)15-23-10(11-7-6-8-28-11)9-12(18(20,21)22)26(15)25-14/h1,6-9H,5H2,2-3H3,(H,24,27)
InChIKey GYXMUIFHQHNZMU-UHFFFAOYSA-N
Mol Weight 471.3 g/mol
Molecular Formula C18H14BrF3N4OS
Exact Mass 470.00238 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtEeoKv6wKL
Name 3-Bromanyl-N-(3-methylpent-1-yn-3-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Alternate Name(s) 3-Bromo-N-(1-ethyl-1-methyl-prop-2-ynyl)-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-Bromo-N-(3-methylpent-1-yn-3-yl)-5-thiophen-2-yl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide 3-Bromo-N-(3-methylpent-1-yn-3-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
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Formula C18H14BrF3N4OS
InChI InChI=1S/C18H14BrF3N4OS/c1-4-17(3,5-2)24-16(27)14-13(19)15-23-10(11-7-6-8-28-11)9-12(18(20,21)22)26(15)25-14/h1,6-9H,5H2,2-3H3,(H,24,27)
InChIKey GYXMUIFHQHNZMU-UHFFFAOYSA-N
Molecular Weight 471.296 g/mol
SMILES N(C(c1c(c2[n](C(C(F)(F)F)=CC(=N2)c2sccc2)n1)Br)=O)C(C#C)(CC)C
SPLASH splash10-0096-6749700000-10551a177559e13e1063
Wiley ID 1443493