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3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propylsulfonyl)-3-thienyl]-4-isoxazolecarboxamide

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3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propylsulfonyl)-3-thienyl]-4-isoxazolecarboxamide
SpectraBase Compound ID D9l3WONTqdT
InChI InChI=1S/C18H16ClFN2O4S2/c1-3-7-28(24,25)14-9-27-8-13(14)21-18(23)15-10(2)26-22-17(15)16-11(19)5-4-6-12(16)20/h4-6,8-9H,3,7H2,1-2H3,(H,21,23)
InChIKey QHVOMEMRCSEBSH-UHFFFAOYSA-N
Mol Weight 442.91 g/mol
Molecular Formula C18H16ClFN2O4S2
Exact Mass 442.022405 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6KQ1TWDoaks
Name 3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL-N-[4-(PROPYLSULFONYL)-3-THIENYL]-4-ISOXAZOLECARBOXAMIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16ClFN2O4S2
InChI InChI=1S/C18H16ClFN2O4S2/c1-3-7-28(24,25)14-9-27-8-13(14)21-18(23)15-10(2)26-22-17(15)16-11(19)5-4-6-12(16)20/h4-6,8-9H,3,7H2,1-2H3,(H,21,23)
InChIKey QHVOMEMRCSEBSH-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 127-129C
Molecular Weight 442.92
Solvent CDCl3; Reference=TMS; Temperature 297K