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methyl 2-({[2-(1,3-benzodioxol-5-yl)-4-quinolinyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID 8awS3hT8mgG
InChI InChI=1S/C26H20N2O5S/c1-31-26(30)23-16-6-4-8-22(16)34-25(23)28-24(29)17-12-19(27-18-7-3-2-5-15(17)18)14-9-10-20-21(11-14)33-13-32-20/h2-3,5,7,9-12H,4,6,8,13H2,1H3,(H,28,29)
InChIKey LBYISAINTLCGCK-UHFFFAOYSA-N
Mol Weight 472.52 g/mol
Molecular Formula C26H20N2O5S
Exact Mass 472.109293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 507EBb6PsXK
Name methyl 2-({[2-(1,3-benzodioxol-5-yl)-4-quinolinyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-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/C26H20N2O5S/c1-31-26(30)23-16-6-4-8-22(16)34-25(23)28-24(29)17-12-19(27-18-7-3-2-5-15(17)18)14-9-10-20-21(11-14)33-13-32-20/h2-3,5,7,9-12H,4,6,8,13H2,1H3,(H,28,29)
InChIKey LBYISAINTLCGCK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17621
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/9063017; UBI_ID: UBI-017624
Temperature 318 °C