(7E)-7-(4-bromobenzylidene)-3-(4-bromophenyl)-2-[(4-methyl-1,3-thiazol-5-yl)carbonyl]-3,3a,4,5,6,7-hexahydro-2H-indazole

SpectraBase Compound ID	9XwFmnlG4Yk
InChI	InChI=1S/C25H21Br2N3OS/c1-15-24(32-14-28-15)25(31)30-23(17-7-11-20(27)12-8-17)21-4-2-3-18(22(21)29-30)13-16-5-9-19(26)10-6-16/h5-14,21,23H,2-4H2,1H3/b18-13+
InChIKey	NZBAHRCKGSPNCE-QGOAFFKASA-N Google Search
Mol Weight	571.33 g/mol
Molecular Formula	C25H21Br2N3OS
Exact Mass	568.977209 g/mol

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SpectraBase Spectrum ID	5p7P9GdsE5O
Name	(7E)-7-(4-bromobenzylidene)-3-(4-bromophenyl)-2-[(4-methyl-1,3-thiazol-5-yl)carbonyl]-3,3a,4,5,6,7-hexahydro-2H-indazole
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H21Br2N3OS/c1-15-24(32-14-28-15)25(31)30-23(17-7-11-20(27)12-8-17)21-4-2-3-18(22(21)29-30)13-16-5-9-19(26)10-6-16/h5-14,21,23H,2-4H2,1H3/b18-13+
InChIKey	NZBAHRCKGSPNCE-QGOAFFKASA-N
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_9018
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: UZI/1024003; Labnumber: Gbb0189; UZI_ID: UZI-009020
Synonyms	7-(4-bromobenzylidene)-3-(4-bromophenyl)-2-[(4-methyl-1,3-thiazol-5-yl)carbonyl]-3,3a,4,5,6,7-hexahydro-2H-indazole
Temperature	308 °C