benzenepropanamide, N-(1,3-benzodioxol-5-ylmethyl)-alpha-[(2-thienylsulfonyl)amino]-

SpectraBase Compound ID	4MZ8iun8zOW
InChI	InChI=1S/C21H20N2O5S2/c24-21(22-13-16-8-9-18-19(12-16)28-14-27-18)17(11-15-5-2-1-3-6-15)23-30(25,26)20-7-4-10-29-20/h1-10,12,17,23H,11,13-14H2,(H,22,24)
InChIKey	XKPRXESUAWCUDY-UHFFFAOYSA-N Google Search
Mol Weight	444.52 g/mol
Molecular Formula	C21H20N2O5S2
Exact Mass	444.081364 g/mol

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SpectraBase Spectrum ID	HsaaPPdtxpG
Name	benzenepropanamide, N-(1,3-benzodioxol-5-ylmethyl)-alpha-[(2-thienylsulfonyl)amino]-
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/C21H20N2O5S2/c24-21(22-13-16-8-9-18-19(12-16)28-14-27-18)17(11-15-5-2-1-3-6-15)23-30(25,26)20-7-4-10-29-20/h1-10,12,17,23H,11,13-14H2,(H,22,24)
InChIKey	XKPRXESUAWCUDY-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_8055
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: NMR/12258169