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(3-R,7A-R)-6-(4-METHYLBENZYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
SpectraBase Compound ID 8SKflrvShBq
InChI InChI=1S/C20H17N3O3S/c1-12-6-8-13(9-7-12)10-22-17(24)16-11-27-20(23(16)19(22)26)14-4-2-3-5-15(14)21-18(20)25/h2-9,16H,10-11H2,1H3,(H,21,25)
InChIKey MCPQMUHSRIYYPQ-UHFFFAOYSA-N
Mol Weight 379.43 g/mol
Molecular Formula C20H17N3O3S
Exact Mass 379.099063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CmyknbjyK2b
Name (3-R,7A-R)-6-(4-METHYLBENZYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17N3O3S
InChI InChI=1S/C20H17N3O3S/c1-12-6-8-13(9-7-12)10-22-17(24)16-11-27-20(23(16)19(22)26)14-4-2-3-5-15(14)21-18(20)25/h2-9,16H,10-11H2,1H3,(H,21,25)
InChIKey MCPQMUHSRIYYPQ-UHFFFAOYSA-N
Literature Reference Author I.GOMEZ-MONTERREY,A.BERTAMINO,A.PORTA,A.CAROTENUTO,S.MUSELLA ,C.AQUINO,I.GRANATA,
Literature Reference Citation J.MED.CHEM.,53,8319(2010)
Literature Reference DOI 10.1021/jm100838z
Molecular Weight 379.433 g/mol
Solvent CDCl3
Source File Reference UWMZ47605