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1-[4-(METHYLSULFONYL)-PHENYL]-3-(4-METHYLPHENYL)-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID 1W01Jygk2Sp
InChI InChI=1S/C18H19N3O2S2/c1-4-24-18-19-17(14-7-5-13(2)6-8-14)20-21(18)15-9-11-16(12-10-15)25(3,22)23/h5-12H,4H2,1-3H3
InChIKey AIQFCBKJNUSYPU-UHFFFAOYSA-N
Mol Weight 373.49 g/mol
Molecular Formula C18H19N3O2S2
Exact Mass 373.091869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B3DbcFJioii
Name 1-[4-(METHYLSULFONYL)-PHENYL]-3-(4-METHYLPHENYL)-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19N3O2S2
InChI InChI=1S/C18H19N3O2S2/c1-4-24-18-19-17(14-7-5-13(2)6-8-14)20-21(18)15-9-11-16(12-10-15)25(3,22)23/h5-12H,4H2,1-3H3
InChIKey AIQFCBKJNUSYPU-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 373.488 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWLU22209