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N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide

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N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID ApbsTeKw2ZL
InChI InChI=1S/C32H33N3O3S/c1-6-32(2,3)19-11-13-22-25(18-33)31(39-29(22)15-19)35-30(36)24-17-27(34-26-10-8-7-9-21(24)26)23-14-12-20(37-4)16-28(23)38-5/h7-10,12,14,16-17,19H,6,11,13,15H2,1-5H3,(H,35,36)
InChIKey OXIDDKXAUCULMB-UHFFFAOYSA-N
Mol Weight 539.7 g/mol
Molecular Formula C32H33N3O3S
Exact Mass 539.224263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3vruwFmtsmC
Name N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide
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/C32H33N3O3S/c1-6-32(2,3)19-11-13-22-25(18-33)31(39-29(22)15-19)35-30(36)24-17-27(34-26-10-8-7-9-21(24)26)23-14-12-20(37-4)16-28(23)38-5/h7-10,12,14,16-17,19H,6,11,13,15H2,1-5H3,(H,35,36)
InChIKey OXIDDKXAUCULMB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1874
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/8032836; UBI_ID: UBI-001875
Temperature 318 °C