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

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methyl 2-{[{(2E)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID JUPGc6U6zvj
InChI InChI=1S/C20H21N3O5S/c1-11(12-7-3-5-9-14(12)24)22-23-18(26)17(25)21-19-16(20(27)28-2)13-8-4-6-10-15(13)29-19/h3,5,7,9,24H,4,6,8,10H2,1-2H3,(H,21,25)(H,23,26)/b22-11+
InChIKey XIOKHKYAWPZRHK-SSDVNMTOSA-N
Mol Weight 415.46 g/mol
Molecular Formula C20H21N3O5S
Exact Mass 415.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kqsp3dQ0sMf
Name methyl 2-{[{(2E)-2-[1-(2-hydroxyphenyl)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/C20H21N3O5S/c1-11(12-7-3-5-9-14(12)24)22-23-18(26)17(25)21-19-16(20(27)28-2)13-8-4-6-10-15(13)29-19/h3,5,7,9,24H,4,6,8,10H2,1-2H3,(H,21,25)(H,23,26)/b22-11+
InChIKey XIOKHKYAWPZRHK-SSDVNMTOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20997
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: D51921; Labnumber: NIG-P1246; SBI_ID: SBI-021001
Synonyms methyl 2-{[{2-[1-(2-hydroxyphenyl)ethylidene]hydrazino}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 318 °C