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3-methyl-1-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl}-2-thiohydantoin
SpectraBase Compound ID 9vRsuBBwmmU
InChI InChI=1S/C18H13F3N4O3S3/c1-23-16(26)10-24(17(23)29)31(27,28)12-6-4-11(5-7-12)25-13(14-3-2-8-30-14)9-15(22-25)18(19,20)21/h2-9H,10H2,1H3
InChIKey RHDDZGQTKRCRKO-UHFFFAOYSA-N
Mol Weight 486.5 g/mol
Molecular Formula C18H13F3N4O3S3
Exact Mass 486.010188 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HlX9l4Jjpbn
Name 3-METHYL-1-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}-2-THIOHYDANTOIN
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3N4O3S3
InChI InChI=1S/C18H13F3N4O3S3/c1-23-16(26)10-24(17(23)29)31(27,28)12-6-4-11(5-7-12)25-13(14-3-2-8-30-14)9-15(22-25)18(19,20)21/h2-9H,10H2,1H3
InChIKey RHDDZGQTKRCRKO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 200-202C
Molecular Weight 486.52
Solvent CDCl3; Reference=TMS; Temperature 297K