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3-thiophenecarboxylic acid, 2-[[(4-chloro-2-methylphenoxy)acetyl]amino]-4-methyl-5-(1-pyrrolidinylcarbonyl)-, ethyl ester

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3-thiophenecarboxylic acid, 2-[[(4-chloro-2-methylphenoxy)acetyl]amino]-4-methyl-5-(1-pyrrolidinylcarbonyl)-, ethyl ester
SpectraBase Compound ID G7dGZ2G7wPg
InChI InChI=1S/C22H25ClN2O5S/c1-4-29-22(28)18-14(3)19(21(27)25-9-5-6-10-25)31-20(18)24-17(26)12-30-16-8-7-15(23)11-13(16)2/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,24,26)
InChIKey LCCWEKTWUPRZFQ-UHFFFAOYSA-N
Mol Weight 464.96 g/mol
Molecular Formula C22H25ClN2O5S
Exact Mass 464.117271 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8gFd3XgskYj
Name 3-thiophenecarboxylic acid, 2-[[(4-chloro-2-methylphenoxy)acetyl]amino]-4-methyl-5-(1-pyrrolidinylcarbonyl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.117270782 u
Formula C22H25ClN2O5S
InChI InChI=1S/C22H25ClN2O5S/c1-4-29-22(28)18-14(3)19(21(27)25-9-5-6-10-25)31-20(18)24-17(26)12-30-16-8-7-15(23)11-13(16)2/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,24,26)
InChIKey LCCWEKTWUPRZFQ-UHFFFAOYSA-N
Molecular Weight 464.964 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11361
Solvent DMSO-d6
Source Vendor ID: NMR/10261359; Lab Info: SAS; Lab Number: SAS-tst3936
Temperature 29.85 °C