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1-[4-(METHYLSULFONYL)-PHENYL]-3-(4-FLUOROPHENYL)-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE

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1-[4-(METHYLSULFONYL)-PHENYL]-3-(4-FLUOROPHENYL)-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID 2CDARsI6eEE
InChI InChI=1S/C17H16FN3O2S2/c1-3-24-17-19-16(12-4-6-13(18)7-5-12)20-21(17)14-8-10-15(11-9-14)25(2,22)23/h4-11H,3H2,1-2H3
InChIKey SAUYTINKFARSDR-UHFFFAOYSA-N
Mol Weight 377.45 g/mol
Molecular Formula C17H16FN3O2S2
Exact Mass 377.066797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 797b2rUmptP
Name 1-[4-(METHYLSULFONYL)-PHENYL]-3-(4-FLUOROPHENYL)-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16FN3O2S2
InChI InChI=1S/C17H16FN3O2S2/c1-3-24-17-19-16(12-4-6-13(18)7-5-12)20-21(17)14-8-10-15(11-9-14)25(2,22)23/h4-11H,3H2,1-2H3
InChIKey SAUYTINKFARSDR-UHFFFAOYSA-N
Literature Reference Author L.NAVIDPOUR,L.KARIMI,M.AMINI,M.VOSOOGHI,A.SHAFIEE
Literature Reference Citation J.HETCYCL.CHEM.,41,201(2004)
Literature Reference DOI 10.1002/jhet.5570410209
Molecular Weight 377.451 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWLU22205