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5-{[(2E)-3-(2-chlorophenyl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide
SpectraBase Compound ID 9wbHxXcUC6L
InChI InChI=1S/C20H20ClN3O2S/c1-4-24(5-2)20(26)18-13(3)15(12-22)19(27-18)23-17(25)11-10-14-8-6-7-9-16(14)21/h6-11H,4-5H2,1-3H3,(H,23,25)/b11-10+
InChIKey MQYJPIQZBPTUMU-ZHACJKMWSA-N
Mol Weight 401.91 g/mol
Molecular Formula C20H20ClN3O2S
Exact Mass 401.096476 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5xqHqS4JDZI
Name 5-{[(2E)-3-(2-chlorophenyl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide
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/C20H20ClN3O2S/c1-4-24(5-2)20(26)18-13(3)15(12-22)19(27-18)23-17(25)11-10-14-8-6-7-9-16(14)21/h6-11H,4-5H2,1-3H3,(H,23,25)/b11-10+
InChIKey MQYJPIQZBPTUMU-ZHACJKMWSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1921
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/8036487; UBI_ID: UBI-001922
Synonyms 5-{[3-(2-chlorophenyl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide
Temperature 313 °C