N-[4-[4-[3-(benzylamino)-4-nitro-phenyl]piperazin-1-yl]sulfonylphenyl]acetamide

SpectraBase Compound ID	CmJYB9HHjm7
InChI	InChI=1S/C25H27N5O5S/c1-19(31)27-21-7-10-23(11-8-21)36(34,35)29-15-13-28(14-16-29)22-9-12-25(30(32)33)24(17-22)26-18-20-5-3-2-4-6-20/h2-12,17,26H,13-16,18H2,1H3,(H,27,31)
InChIKey	LDXVJLDFQAZKPK-UHFFFAOYSA-N Google Search
Mol Weight	509.58 g/mol
Molecular Formula	C25H27N5O5S
Exact Mass	509.17329 g/mol

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SpectraBase Spectrum ID	1zsI8nxMvXo
Name	acetamide, N-[4-[[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]-1-piperazinyl]sulfonyl]phenyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	509.173290158 u
Formula	C25H27N5O5S
InChI	InChI=1S/C25H27N5O5S/c1-19(31)27-21-7-10-23(11-8-21)36(34,35)29-15-13-28(14-16-29)22-9-12-25(30(32)33)24(17-22)26-18-20-5-3-2-4-6-20/h2-12,17,26H,13-16,18H2,1H3,(H,27,31)
InChIKey	LDXVJLDFQAZKPK-UHFFFAOYSA-N
Molecular Weight	509.581 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_16284
Solvent	DMSO-d6
Source	Vendor ID: NMR/10321284; Lab Info: LP; Lab Number: LP-2501533