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4-(4-methoxy-3-{[(4-methylphenyl)sulfanyl]methyl}phenyl)-2-methyl-N-(4-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
SpectraBase Compound ID 6D2c93ScEIu
InChI InChI=1S/C32H33N3O3S/c1-19-8-11-24(12-9-19)39-18-23-17-22(10-13-27(23)38-4)30-29(32(37)35-28-16-20(2)14-15-33-28)21(3)34-25-6-5-7-26(36)31(25)30/h8-17,30,34H,5-7,18H2,1-4H3,(H,33,35,37)
InChIKey DIYKFGDQOQTWDL-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 Hu5zVV4cN3z
Name 4-(4-methoxy-3-{[(4-methylphenyl)sulfanyl]methyl}phenyl)-2-methyl-N-(4-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-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/c1-19-8-11-24(12-9-19)39-18-23-17-22(10-13-27(23)38-4)30-29(32(37)35-28-16-20(2)14-15-33-28)21(3)34-25-6-5-7-26(36)31(25)30/h8-17,30,34H,5-7,18H2,1-4H3,(H,33,35,37)
InChIKey DIYKFGDQOQTWDL-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18895
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/9131075; UBI_ID: UBI-018898
Temperature 313 °C