2-[(E)-(2-(4-benzyl-1-piperazinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate

SpectraBase Compound ID	IDAQj98qM1b
InChI	InChI=1S/C27H25N3O4S2/c31-26-25(19-22-11-7-8-14-24(22)34-36(32,33)23-12-5-2-6-13-23)35-27(28-26)30-17-15-29(16-18-30)20-21-9-3-1-4-10-21/h1-14,19H,15-18,20H2/b25-19+
InChIKey	SLNJCVZISRMLCG-NCELDCMTSA-N Google Search
Mol Weight	519.63 g/mol
Molecular Formula	C27H25N3O4S2
Exact Mass	519.128649 g/mol

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SpectraBase Spectrum ID	G5tqbkwzQpu
Name	2-[(E)-(2-(4-benzyl-1-piperazinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate
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/C27H25N3O4S2/c31-26-25(19-22-11-7-8-14-24(22)34-36(32,33)23-12-5-2-6-13-23)35-27(28-26)30-17-15-29(16-18-30)20-21-9-3-1-4-10-21/h1-14,19H,15-18,20H2/b25-19+
InChIKey	SLNJCVZISRMLCG-NCELDCMTSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10965
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: E03571; Labnumber: EX00112760; SBI_ID: SBI-010968
Synonyms	2-[(2-(4-benzyl-1-piperazinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate
Temperature	315 °C