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(3-R,7A-R)-6-(4-CHLOROBENZYL)-1'-(4-METHYLBENZOYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
SpectraBase Compound ID GvRAmWYUgFc
InChI InChI=1S/C27H20ClN3O4S/c1-16-6-10-18(11-7-16)23(32)30-21-5-3-2-4-20(21)27(25(30)34)31-22(15-36-27)24(33)29(26(31)35)14-17-8-12-19(28)13-9-17/h2-13,22H,14-15H2,1H3
InChIKey FTRDFLCJKASACB-UHFFFAOYSA-N
Mol Weight 517.99 g/mol
Molecular Formula C27H20ClN3O4S
Exact Mass 517.086305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JYxkqwoWTu3
Name (3-R,7A-R)-6-(4-CHLOROBENZYL)-1'-(4-METHYLBENZOYL)-1-H-SPIRO-[IMIDAZO-[1.5-C]-THIAZOLE-3,3'-INDOLINE]-2',5,7-(6-H,7A-H)-TRIONE
Compound Number 13G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H20ClN3O4S
InChI InChI=1S/C27H20ClN3O4S/c1-16-6-10-18(11-7-16)23(32)30-21-5-3-2-4-20(21)27(25(30)34)31-22(15-36-27)24(33)29(26(31)35)14-17-8-12-19(28)13-9-17/h2-13,22H,14-15H2,1H3
InChIKey FTRDFLCJKASACB-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 517.987 g/mol
Solvent CDCl3
Source File Reference UWMZ47625