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2-ethyl 4-isopropyl 5-{[(2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID LU8Q1Y8X0eD
InChI InChI=1S/C20H25N3O5S/c1-7-27-20(26)17-12(4)16(19(25)28-11(2)3)18(29-17)22-15(24)9-8-14-10-21-23(6)13(14)5/h8-11H,7H2,1-6H3,(H,22,24)/b9-8+
InChIKey SZBCJUOOURRSEM-CMDGGOBGSA-N
Mol Weight 419.5 g/mol
Molecular Formula C20H25N3O5S
Exact Mass 419.151492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JWu0rtpbpRs
Name 2-ethyl 4-isopropyl 5-{[(2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-3-methyl-2,4-thiophenedicarboxylate
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/C20H25N3O5S/c1-7-27-20(26)17-12(4)16(19(25)28-11(2)3)18(29-17)22-15(24)9-8-14-10-21-23(6)13(14)5/h8-11H,7H2,1-6H3,(H,22,24)/b9-8+
InChIKey SZBCJUOOURRSEM-CMDGGOBGSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20860
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/9315455; UBI_ID: UBI-020864
Synonyms 2-ethyl 4-isopropyl 5-{[3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-3-methyl-2,4-thiophenedicarboxylate
Temperature 318 °C