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1-{[5-(p-chlorophenyl)-3-(methylthio)-4-isoxazolyl]carbonyl}-3-(2,4-difluorophenyl)urea

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1-{[5-(p-chlorophenyl)-3-(methylthio)-4-isoxazolyl]carbonyl}-3-(2,4-difluorophenyl)urea
SpectraBase Compound ID 4ZpIsvn7Hyx
InChI InChI=1S/C18H12ClF2N3O3S/c1-28-17-14(15(27-24-17)9-2-4-10(19)5-3-9)16(25)23-18(26)22-13-7-6-11(20)8-12(13)21/h2-8H,1H3,(H2,22,23,25,26)
InChIKey MHKLOJDGSNOUQN-UHFFFAOYSA-N
Mol Weight 423.82 g/mol
Molecular Formula C18H12ClF2N3O3S
Exact Mass 423.025596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6o8aaG360Ks
Name 1-{[5-(p-CHLOROPHENYL)-3-(METHYLTHIO)-4-ISOXAZOLYL]CARBONYL}-3-(2,4-DIFLUOROPHENYL)UREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12ClF2N3O3S
InChI InChI=1S/C18H12ClF2N3O3S/c1-28-17-14(15(27-24-17)9-2-4-10(19)5-3-9)16(25)23-18(26)22-13-7-6-11(20)8-12(13)21/h2-8H,1H3,(H2,22,23,25,26)
InChIKey MHKLOJDGSNOUQN-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 165-167C
Molecular Weight 423.83
Solvent Polysol; Reference=TMS; Temperature 297K