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2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2,3-dichlorophenyl)acetamide

View entire compound with spectra: 1 NMR

2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2,3-dichlorophenyl)acetamide
SpectraBase Compound ID 7BrOeI87wwi
InChI InChI=1S/C27H25Cl2N3O5S/c1-35-20-10-14(11-21(36-2)26(20)37-3)23-15(12-30)27(32-17-7-5-9-19(33)24(17)23)38-13-22(34)31-18-8-4-6-16(28)25(18)29/h4,6,8,10-11,23,32H,5,7,9,13H2,1-3H3,(H,31,34)
InChIKey LDQKAWGZMUXYGO-UHFFFAOYSA-N
Mol Weight 574.48 g/mol
Molecular Formula C27H25Cl2N3O5S
Exact Mass 573.089197 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cwoh6nsjR2s
Name 2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2,3-dichlorophenyl)acetamide
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/C27H25Cl2N3O5S/c1-35-20-10-14(11-21(36-2)26(20)37-3)23-15(12-30)27(32-17-7-5-9-19(33)24(17)23)38-13-22(34)31-18-8-4-6-16(28)25(18)29/h4,6,8,10-11,23,32H,5,7,9,13H2,1-3H3,(H,31,34)
InChIKey LDQKAWGZMUXYGO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22487
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: D59843; Labnumber: SHEL-0043; SBI_ID: SBI-022491
Temperature 308 °C