(9E)-3-(4-bromophenyl)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline

SpectraBase Compound ID	J0NKdZngaL
InChI	InChI=1S/C29H21BrF2N2S/c30-22-10-6-19(7-11-22)26-17-35-29-33-27-21(16-18-4-12-23(31)13-5-18)2-1-3-25(27)28(34(26)29)20-8-14-24(32)15-9-20/h4-17,28H,1-3H2/b21-16+
InChIKey	AFLSBKNEEABTPO-LTGZKZEYSA-N Google Search
Mol Weight	547.46 g/mol
Molecular Formula	C29H21BrF2N2S
Exact Mass	546.057689 g/mol

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SpectraBase Spectrum ID	3A3YDcH4Ppv
Name	(9E)-3-(4-bromophenyl)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C29H21BrF2N2S/c30-22-10-6-19(7-11-22)26-17-35-29-33-27-21(16-18-4-12-23(31)13-5-18)2-1-3-25(27)28(34(26)29)20-8-14-24(32)15-9-20/h4-17,28H,1-3H2/b21-16+
InChIKey	AFLSBKNEEABTPO-LTGZKZEYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_8079
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 132460; Labnumber: GELNCE-009; VK_ID: VK-008083
Synonyms	3-(4-bromophenyl)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Temperature	318 °C