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methyl 2-({[2-(3-chlorophenyl)-3-methyl-4-quinolinyl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IL69VhPfDuM
InChI InChI=1S/C29H27ClN2O3S/c1-4-17-12-13-21-23(14-17)36-28(25(21)29(34)35-3)32-27(33)24-16(2)26(18-8-7-9-19(30)15-18)31-22-11-6-5-10-20(22)24/h5-11,15,17H,4,12-14H2,1-3H3,(H,32,33)
InChIKey GWIPPWRMAKYCEN-UHFFFAOYSA-N
Mol Weight 519.06 g/mol
Molecular Formula C29H27ClN2O3S
Exact Mass 518.143092 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dE0rKCX0kN
Name methyl 2-({[2-(3-chlorophenyl)-3-methyl-4-quinolinyl]carbonyl}amino)-6-ethyl-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/C29H27ClN2O3S/c1-4-17-12-13-21-23(14-17)36-28(25(21)29(34)35-3)32-27(33)24-16(2)26(18-8-7-9-19(30)15-18)31-22-11-6-5-10-20(22)24/h5-11,15,17H,4,12-14H2,1-3H3,(H,32,33)
InChIKey GWIPPWRMAKYCEN-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1855
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: UZI/9525437; Labnumber: AM-AC/0037368; UZI_ID: UZI-001857
Temperature 308 °C