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1-[4-(METHYLSULFONYL)-PHENYL]-3-PHENYL-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID 4pYnzfFXWrT
InChI InChI=1S/C17H17N3O2S2/c1-3-23-17-18-16(13-7-5-4-6-8-13)19-20(17)14-9-11-15(12-10-14)24(2,21)22/h4-12H,3H2,1-2H3
InChIKey HMEOVKFVLFSWPI-UHFFFAOYSA-N
Mol Weight 359.46 g/mol
Molecular Formula C17H17N3O2S2
Exact Mass 359.076219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNEsBwqz8Np
Name 1-[4-(METHYLSULFONYL)-PHENYL]-3-PHENYL-5-(ETHYLTHIO)-1H-1,2,4-TRIAZOLE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N3O2S2
InChI InChI=1S/C17H17N3O2S2/c1-3-23-17-18-16(13-7-5-4-6-8-13)19-20(17)14-9-11-15(12-10-14)24(2,21)22/h4-12H,3H2,1-2H3
InChIKey HMEOVKFVLFSWPI-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 359.461 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWLU22203