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(3-R,7A-R)-6-(4-CHLOROBENZYL)-5'-METHYL-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
SpectraBase Compound ID EnaQJcXMOGE
InChI InChI=1S/C20H16ClN3O3S/c1-11-2-7-15-14(8-11)20(18(26)22-15)24-16(10-28-20)17(25)23(19(24)27)9-12-3-5-13(21)6-4-12/h2-8,16H,9-10H2,1H3,(H,22,26)
InChIKey MHNKHQZOBNNIOM-UHFFFAOYSA-N
Mol Weight 413.88 g/mol
Molecular Formula C20H16ClN3O3S
Exact Mass 413.06009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HPUrbYQdENY
Name (3-R,7A-R)-6-(4-CHLOROBENZYL)-5'-METHYL-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16ClN3O3S
InChI InChI=1S/C20H16ClN3O3S/c1-11-2-7-15-14(8-11)20(18(26)22-15)24-16(10-28-20)17(25)23(19(24)27)9-12-3-5-13(21)6-4-12/h2-8,16H,9-10H2,1H3,(H,22,26)
InChIKey MHNKHQZOBNNIOM-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 413.878 g/mol
Solvent CDCl3
Source File Reference UWMZ47611