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(3-R,7A-R)-6-(4-CHLOROBENZYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
SpectraBase Compound ID A81PbYPrnQs
InChI InChI=1S/C19H14ClN3O3S/c20-12-7-5-11(6-8-12)9-22-16(24)15-10-27-19(23(15)18(22)26)13-3-1-2-4-14(13)21-17(19)25/h1-8,15H,9-10H2,(H,21,25)
InChIKey POVQHLNFAUGINO-UHFFFAOYSA-N
Mol Weight 399.85 g/mol
Molecular Formula C19H14ClN3O3S
Exact Mass 399.04444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID uYtlI91jmy
Name (3-R,7A-R)-6-(4-CHLOROBENZYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H14ClN3O3S
InChI InChI=1S/C19H14ClN3O3S/c20-12-7-5-11(6-8-12)9-22-16(24)15-10-27-19(23(15)18(22)26)13-3-1-2-4-14(13)21-17(19)25/h1-8,15H,9-10H2,(H,21,25)
InChIKey POVQHLNFAUGINO-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 399.851 g/mol
Solvent CDCl3
Source File Reference UWMZ47606