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benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[2-(4-methyl-1-piperazinyl)-5-nitrobenzoyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[2-(4-methyl-1-piperazinyl)-5-nitrobenzoyl]amino]-, ethyl ester
SpectraBase Compound ID 666R9HyujEU
InChI InChI=1S/C23H28N4O5S/c1-3-32-23(29)20-16-6-4-5-7-19(16)33-22(20)24-21(28)17-14-15(27(30)31)8-9-18(17)26-12-10-25(2)11-13-26/h8-9,14H,3-7,10-13H2,1-2H3,(H,24,28)
InChIKey WYYAQACRPFDASG-UHFFFAOYSA-N
Mol Weight 472.56 g/mol
Molecular Formula C23H28N4O5S
Exact Mass 472.178041 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BeWdF7KBE4S
Name benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[2-(4-methyl-1-piperazinyl)-5-nitrobenzoyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.178041187 u
Formula C23H28N4O5S
InChI InChI=1S/C23H28N4O5S/c1-3-32-23(29)20-16-6-4-5-7-19(16)33-22(20)24-21(28)17-14-15(27(30)31)8-9-18(17)26-12-10-25(2)11-13-26/h8-9,14H,3-7,10-13H2,1-2H3,(H,24,28)
InChIKey WYYAQACRPFDASG-UHFFFAOYSA-N
Molecular Weight 472.560 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2236
Solvent DMSO-d6
Source Vendor ID: NMR/9213407; Lab Info: DS; Lab Number: DS-0000959