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3-Thiophenecarboxylic acid, 5-[[(3-chloro-4-methylphenyl)amino]carbonyl]-4-methyl-2-[(4-methylbenzoyl)amino]-, ethyl ester

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3-Thiophenecarboxylic acid, 5-[[(3-chloro-4-methylphenyl)amino]carbonyl]-4-methyl-2-[(4-methylbenzoyl)amino]-, ethyl ester
SpectraBase Compound ID 4PFL7zwfraX
InChI InChI=1S/C24H23ClN2O4S/c1-5-31-24(30)19-15(4)20(22(29)26-17-11-8-14(3)18(25)12-17)32-23(19)27-21(28)16-9-6-13(2)7-10-16/h6-12H,5H2,1-4H3,(H,26,29)(H,27,28)
InChIKey NAUDQUSYPRRAQU-UHFFFAOYSA-N
Mol Weight 470.97 g/mol
Molecular Formula C24H23ClN2O4S
Exact Mass 470.106706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3fUxc3Xss3l
Name 3-Thiophenecarboxylic acid, 5-[[(3-chloro-4-methylphenyl)amino]carbonyl]-4-methyl-2-[(4-methylbenzoyl)amino]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.106706099 u
Formula C24H23ClN2O4S
InChI InChI=1S/C24H23ClN2O4S/c1-5-31-24(30)19-15(4)20(22(29)26-17-11-8-14(3)18(25)12-17)32-23(19)27-21(28)16-9-6-13(2)7-10-16/h6-12H,5H2,1-4H3,(H,26,29)(H,27,28)
InChIKey NAUDQUSYPRRAQU-UHFFFAOYSA-N
Molecular Weight 470.971 g/mol
SMILES N(C(C1=C(C(=C(S1)NC(C=1C=CC(=CC1)C)=O)C(=O)OCC)C)=O)C1=CC(Cl)=C(C=C1)C