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N-[4-(4-sec-butylphenyl)-3-cyano-5-methyl-2-thienyl]-2-(4-isobutylphenyl)-4-quinolinecarboxamide

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N-[4-(4-sec-butylphenyl)-3-cyano-5-methyl-2-thienyl]-2-(4-isobutylphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID 2heVg9nfgfp
InChI InChI=1S/C36H35N3OS/c1-6-23(4)26-15-17-28(18-16-26)34-24(5)41-36(31(34)21-37)39-35(40)30-20-33(38-32-10-8-7-9-29(30)32)27-13-11-25(12-14-27)19-22(2)3/h7-18,20,22-23H,6,19H2,1-5H3,(H,39,40)
InChIKey HQRXKYGAMRLQIK-UHFFFAOYSA-N
Mol Weight 557.8 g/mol
Molecular Formula C36H35N3OS
Exact Mass 557.250084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FqCFSIzTDdv
Name N-[4-(4-sec-butylphenyl)-3-cyano-5-methyl-2-thienyl]-2-(4-isobutylphenyl)-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/C36H35N3OS/c1-6-23(4)26-15-17-28(18-16-26)34-24(5)41-36(31(34)21-37)39-35(40)30-20-33(38-32-10-8-7-9-29(30)32)27-13-11-25(12-14-27)19-22(2)3/h7-18,20,22-23H,6,19H2,1-5H3,(H,39,40)
InChIKey HQRXKYGAMRLQIK-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1792
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/9388109; Labnumber: AM-AC/0005169; UZI_ID: UZI-001794
Temperature 308 °C