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2-BENZYL-5-BENZYLCARBAMOYLIMINO-4-(PARA-NITROPHENYL)-1,2,4-THIADIAZOLIDIN-3-ONE
SpectraBase Compound ID HCjg4HDK1xL
InChI InChI=1S/C23H19N5O4S/c29-21(24-15-17-7-3-1-4-8-17)25-22-27(19-11-13-20(14-12-19)28(31)32)23(30)26(33-22)16-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,24,29)/b25-22-
InChIKey QPAOGLCPHPRCPP-LVWGJNHUSA-N
Mol Weight 461.5 g/mol
Molecular Formula C23H19N5O4S
Exact Mass 461.115775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KiYpYdIMVQf
Name 2-BENZYL-5-BENZYLCARBAMOYLIMINO-4-(PARA-NITROPHENYL)-1,2,4-THIADIAZOLIDIN-3-ONE
Compound Number 9I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H19N5O4S
InChI InChI=1S/C23H19N5O4S/c29-21(24-15-17-7-3-1-4-8-17)25-22-27(19-11-13-20(14-12-19)28(31)32)23(30)26(33-22)16-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,24,29)/b25-22-
InChIKey QPAOGLCPHPRCPP-LVWGJNHUSA-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 461.495 g/mol
Solvent CDCl3
Source File Reference UWCP3595