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2-BENZYL-5-BENZYLCARBAMOYLIMINO-4-METHYL-1,2,4-THIADIAZOLIDIN-3-ONE
SpectraBase Compound ID IhuJ11hRQsy
InChI InChI=1S/C18H18N4O2S/c1-21-17(20-16(23)19-12-14-8-4-2-5-9-14)25-22(18(21)24)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,19,23)/b20-17-
InChIKey ORKYIKRFQALZEA-JZJYNLBNSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYBgPGp45EC
Name 2-BENZYL-5-BENZYLCARBAMOYLIMINO-4-METHYL-1,2,4-THIADIAZOLIDIN-3-ONE
Compound Number 9E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18N4O2S
InChI InChI=1S/C18H18N4O2S/c1-21-17(20-16(23)19-12-14-8-4-2-5-9-14)25-22(18(21)24)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,19,23)/b20-17-
InChIKey ORKYIKRFQALZEA-JZJYNLBNSA-N
Literature Reference Author G.L'ABBE,E.ALBRECHT,S.TOPPET
Literature Reference Citation J.HETCYCL.CHEM.,28,1619(1991)
Literature Reference DOI 10.1002/jhet.5570280627
Molecular Weight 354.427 g/mol
Solvent CDCl3
Source File Reference UWCP3588