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acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-N-(3-chloro-2-methylphenyl)-
SpectraBase Compound ID IwrZcvRLt9K
InChI InChI=1S/C26H22ClN3O4S/c1-14-17(27)4-2-5-18(14)29-23(32)12-35-26-16(11-28)24(25-19(30-26)6-3-7-20(25)31)15-8-9-21-22(10-15)34-13-33-21/h2,4-5,8-10,24,30H,3,6-7,12-13H2,1H3,(H,29,32)
InChIKey WUXFUKGEEVNAAH-UHFFFAOYSA-N
Mol Weight 507.99 g/mol
Molecular Formula C26H22ClN3O4S
Exact Mass 507.101955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7BA23Jwbmfe
Name acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-N-(3-chloro-2-methylphenyl)-
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/C26H22ClN3O4S/c1-14-17(27)4-2-5-18(14)29-23(32)12-35-26-16(11-28)24(25-19(30-26)6-3-7-20(25)31)15-8-9-21-22(10-15)34-13-33-21/h2,4-5,8-10,24,30H,3,6-7,12-13H2,1H3,(H,29,32)
InChIKey WUXFUKGEEVNAAH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2168
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: NMR/11238453