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ethyl 2-{[{(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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ethyl 2-{[{(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID LPzFOofnnSl
InChI InChI=1S/C21H23N3O6S/c1-3-30-21(29)17-14-6-4-5-7-16(14)31-20(17)22-18(27)19(28)24-23-11(2)13-9-8-12(25)10-15(13)26/h8-10,25-26H,3-7H2,1-2H3,(H,22,27)(H,24,28)/b23-11+
InChIKey AWCFQXNLIHUTGW-FOKLQQMPSA-N
Mol Weight 445.49 g/mol
Molecular Formula C21H23N3O6S
Exact Mass 445.130757 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ioGLlqZNq4
Name ethyl 2-{[{(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C21H23N3O6S/c1-3-30-21(29)17-14-6-4-5-7-16(14)31-20(17)22-18(27)19(28)24-23-11(2)13-9-8-12(25)10-15(13)26/h8-10,25-26H,3-7H2,1-2H3,(H,22,27)(H,24,28)/b23-11+
InChIKey AWCFQXNLIHUTGW-FOKLQQMPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20989
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: D51904; Labnumber: NIG-P0743; SBI_ID: SBI-020993
Synonyms ethyl 2-{[{2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 318 °C