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isopropyl 2-{[(2E)-3-(1-methyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 6fhuLjcRSbs
InChI InChI=1S/C19H23N3O3S/c1-12(2)25-19(24)17-14-6-4-5-7-15(14)26-18(17)21-16(23)9-8-13-10-20-22(3)11-13/h8-12H,4-7H2,1-3H3,(H,21,23)/b9-8+
InChIKey GIJRSQNRQMZBER-CMDGGOBGSA-N
Mol Weight 373.47 g/mol
Molecular Formula C19H23N3O3S
Exact Mass 373.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ENYcTN6dC6V
Name isopropyl 2-{[(2E)-3-(1-methyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C19H23N3O3S/c1-12(2)25-19(24)17-14-6-4-5-7-15(14)26-18(17)21-16(23)9-8-13-10-20-22(3)11-13/h8-12H,4-7H2,1-3H3,(H,21,23)/b9-8+
InChIKey GIJRSQNRQMZBER-CMDGGOBGSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2377
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 9312397; UBI_ID: UBI-002378
Synonyms isopropyl 2-{[3-(1-methyl-1H-pyrazol-4-yl)-2-propenoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 313 °C