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7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID ImF4dNVjNwX
InChI InChI=1S/C21H17ClF2N4O4S/c1-30-14-7-11(8-15(31-2)19(14)32-3)25-20(29)13-10-18-26-12(16-5-4-6-33-16)9-17(21(22,23)24)28(18)27-13/h4-10H,1-3H3,(H,25,29)
InChIKey HTJYPRSTESPTDD-UHFFFAOYSA-N
Mol Weight 494.9 g/mol
Molecular Formula C21H17ClF2N4O4S
Exact Mass 494.06271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WOq2voJnM
Name 7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Alternate Name(s) 7-[chloro(difluoro)methyl]-5-(2-thienyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide 7-[chloro(difluoro)methyl]-5-thiophen-2-yl-N-(3,4,5-trimethoxyphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide 7-[chloro(difluoro)methyl]-5-thiophen-2-yl-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
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Formula C21H17ClF2N4O4S
InChI InChI=1S/C21H17ClF2N4O4S/c1-30-14-7-11(8-15(31-2)19(14)32-3)25-20(29)13-10-18-26-12(16-5-4-6-33-16)9-17(21(22,23)24)28(18)27-13/h4-10H,1-3H3,(H,25,29)
InChIKey HTJYPRSTESPTDD-UHFFFAOYSA-N
Molecular Weight 494.901 g/mol
SMILES N(C(c1n[n]2C(=CC(=Nc2c1)c1sccc1)C(Cl)(F)F)=O)c1cc(OC)c(c(c1)OC)OC
SPLASH splash10-03dl-3204900000-7967710594117924e9bd
Wiley ID 1453840