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[7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]-(2-methylpiperidin-1-yl)methanone
SpectraBase Compound ID 8aAoSOTcrJk
InChI InChI=1S/C18H17ClF2N4OS/c1-11-5-2-3-7-24(11)17(26)13-10-16-22-12(14-6-4-8-27-14)9-15(18(19,20)21)25(16)23-13/h4,6,8-11H,2-3,5,7H2,1H3
InChIKey RSZUVXLNUUQVOB-UHFFFAOYSA-N
Mol Weight 410.87 g/mol
Molecular Formula C18H17ClF2N4OS
Exact Mass 410.077966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lnegglja9Ze
Name [7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]-(2-methylpiperidin-1-yl)methanone
Alternate Name(s) [7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidin-2-yl]-(2-methyl-1-piperidyl)methanone [7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidin-2-yl]-(2-methylpiperidino)methanone [7-[chloro(difluoro)methyl]-5-thiophen-2-yl-2-pyrazolo[1,5-a]pyrimidinyl]-(2-methyl-1-piperidinyl)methanone [7-[chloro(difluoro)methyl]-5-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-2-yl]-(2-methylpiperidin-1-yl)methanone
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Formula C18H17ClF2N4OS
InChI InChI=1S/C18H17ClF2N4OS/c1-11-5-2-3-7-24(11)17(26)13-10-16-22-12(14-6-4-8-27-14)9-15(18(19,20)21)25(16)23-13/h4,6,8-11H,2-3,5,7H2,1H3
InChIKey RSZUVXLNUUQVOB-UHFFFAOYSA-N
Molecular Weight 410.871 g/mol
SMILES C1CCN(C(c2n[n]3C(=CC(=Nc3c2)c2sccc2)C(Cl)(F)F)=O)C(C)C1
SPLASH splash10-0002-9212000000-06faf42670cb5eb4995f
Wiley ID 1453735