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3-Methyl-5-(3-phenylacryloylamino)-2-ethoxycarbonyl-4-methoxycarbonyl thiophene

View entire compound with spectra: 1 NMR

3-Methyl-5-(3-phenylacryloylamino)-2-ethoxycarbonyl-4-methoxycarbonyl thiophene
SpectraBase Compound ID 9Qn6VqWjv3G
InChI InChI=1S/C19H19NO5S/c1-4-25-19(23)16-12(2)15(18(22)24-3)17(26-16)20-14(21)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,20,21)/b11-10+
InChIKey KFNLZUOKFZGNPR-ZHACJKMWSA-N
Mol Weight 373.42 g/mol
Molecular Formula C19H19NO5S
Exact Mass 373.098394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AoYrZK7GjSw
Name 3-Methyl-5-(3-phenylacryloylamino)-2-ethoxycarbonyl-4-methoxycarbonyl thiophene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.098393885 u
Formula C19H19NO5S
InChI InChI=1S/C19H19NO5S/c1-4-25-19(23)16-12(2)15(18(22)24-3)17(26-16)20-14(21)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,20,21)/b11-10+
InChIKey KFNLZUOKFZGNPR-ZHACJKMWSA-N
Molecular Weight 373.423 g/mol
SMILES C1(=CC=CC=C1)\C=C\C(NC=1SC(=C(C1C(=O)OC)C)C(OCC)=O)=O