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N-benzyl-2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID 7QyJeWsWU3I
InChI InChI=1S/C29H34N2O3S/c1-4-24(34-22-16-15-19(2)20(3)17-22)27(32)31-29-26(23-13-9-6-10-14-25(23)35-29)28(33)30-18-21-11-7-5-8-12-21/h5,7-8,11-12,15-17,24H,4,6,9-10,13-14,18H2,1-3H3,(H,30,33)(H,31,32)
InChIKey QNTPUZLGQSNZMQ-UHFFFAOYSA-N
Mol Weight 490.7 g/mol
Molecular Formula C29H34N2O3S
Exact Mass 490.229014 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8GinpPql0gK
Name N-benzyl-2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
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/C29H34N2O3S/c1-4-24(34-22-16-15-19(2)20(3)17-22)27(32)31-29-26(23-13-9-6-10-14-25(23)35-29)28(33)30-18-21-11-7-5-8-12-21/h5,7-8,11-12,15-17,24H,4,6,9-10,13-14,18H2,1-3H3,(H,30,33)(H,31,32)
InChIKey QNTPUZLGQSNZMQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7775
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/1268935; Labnumber: COL6096; UZI_ID: UZI-007777
Temperature 318 °C