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[7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-yl-methanone
SpectraBase Compound ID Hjq9FjbHiwF
InChI InChI=1S/C16H13ClF2N4O2S/c17-16(18,19)13-8-10(12-2-1-7-26-12)20-14-9-11(21-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2
InChIKey WSBVCIVHAYKHKQ-UHFFFAOYSA-N
Mol Weight 398.82 g/mol
Molecular Formula C16H13ClF2N4O2S
Exact Mass 398.041581 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmhVGqrJYMF
Name [7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-yl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClF2N4O2S
InChI InChI=1S/C16H13ClF2N4O2S/c17-16(18,19)13-8-10(12-2-1-7-26-12)20-14-9-11(21-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2
InChIKey WSBVCIVHAYKHKQ-UHFFFAOYSA-N
Molecular Weight 398.816 g/mol
SMILES C1CN(C(c2n[n]3C(=CC(=Nc3c2)c2sccc2)C(Cl)(F)F)=O)CCO1
SPLASH splash10-000i-9331000000-5189475b81e6411a97f7
Synonyms [7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidin-2-yl]-morpholino-methanone [7-[chloro(difluoro)methyl]-5-thiophen-2-yl-2-pyrazolo[1,5-a]pyrimidinyl]-(4-morpholinyl)methanone [7-[chloro(difluoro)methyl]-5-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone
Wiley ID 1465517