2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-methyl-5-[oxo(1-piperidinyl)methyl]-3-thiophenecarboxylic acid ethyl ester

SpectraBase Compound ID	KHaHeGJzUPw
InChI	InChI=1S/C22H24N2O6S/c1-3-28-22(27)17-13(2)18(21(26)24-9-5-4-6-10-24)31-20(17)23-19(25)14-7-8-15-16(11-14)30-12-29-15/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,23,25)
InChIKey	SSHYEJWESWPPCB-UHFFFAOYSA-N Google Search
Mol Weight	444.5 g/mol
Molecular Formula	C22H24N2O6S
Exact Mass	444.135508 g/mol

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SpectraBase Spectrum ID	3MTuzlXsCkv
Name	ethyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-methyl-5-(1-piperidinylcarbonyl)-3-thiophenecarboxylate
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/C22H24N2O6S/c1-3-28-22(27)17-13(2)18(21(26)24-9-5-4-6-10-24)31-20(17)23-19(25)14-7-8-15-16(11-14)30-12-29-15/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,23,25)
InChIKey	SSHYEJWESWPPCB-UHFFFAOYSA-N
NMR Offset	15.3209
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_34865
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: 9685528; SBI_ID: SBI-034869
Temperature	297 °C