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N-(1-adamantylmethyl)-7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID 16PPoY8EWG7
InChI InChI=1S/C23H23ClF2N4OS/c24-23(25,26)19-7-16(18-2-1-3-32-18)28-20-8-17(29-30(19)20)21(31)27-12-22-9-13-4-14(10-22)6-15(5-13)11-22/h1-3,7-8,13-15H,4-6,9-12H2,(H,27,31)
InChIKey AFAWSQCTTWPPHC-UHFFFAOYSA-N
Mol Weight 476.97 g/mol
Molecular Formula C23H23ClF2N4OS
Exact Mass 476.124917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gp9MhsjUky5
Name N-(1-adamantylmethyl)-7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23ClF2N4OS
InChI InChI=1S/C23H23ClF2N4OS/c24-23(25,26)19-7-16(18-2-1-3-32-18)28-20-8-17(29-30(19)20)21(31)27-12-22-9-13-4-14(10-22)6-15(5-13)11-22/h1-3,7-8,13-15H,4-6,9-12H2,(H,27,31)
InChIKey AFAWSQCTTWPPHC-UHFFFAOYSA-N
Molecular Weight 476.974 g/mol
SMILES N(C(c1n[n]2C(=CC(=Nc2c1)c1sccc1)C(F)(F)Cl)=O)CC12CC3CC(C2)CC(C1)C3
SPLASH splash10-000i-4901100000-8d11e839a240eea55ae2
Synonyms N-(1-adamantylmethyl)-7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide N-(1-adamantylmethyl)-7-[chloro(difluoro)methyl]-5-thiophen-2-yl-2-pyrazolo[1,5-a]pyrimidinecarboxamide N-(1-adamantylmethyl)-7-[chloro(difluoro)methyl]-5-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Wiley ID 1443479