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Ethyl 4,5-dimethyl-2-[(3,4,5-triethoxybenzoyl)amino]-3-thiophenecarboxylate

View entire compound with spectra: 2 NMR

Ethyl 4,5-dimethyl-2-[(3,4,5-triethoxybenzoyl)amino]-3-thiophenecarboxylate
SpectraBase Compound ID L1q3lNO8DdB
InChI InChI=1S/C22H29NO6S/c1-7-26-16-11-15(12-17(27-8-2)19(16)28-9-3)20(24)23-21-18(22(25)29-10-4)13(5)14(6)30-21/h11-12H,7-10H2,1-6H3,(H,23,24)
InChIKey HFFLHMCGYSCERT-UHFFFAOYSA-N
Mol Weight 435.54 g/mol
Molecular Formula C22H29NO6S
Exact Mass 435.171559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1THQETzza4Q
Name Ethyl 4,5-dimethyl-2-[(3,4,5-triethoxybenzoyl)amino]-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.171558826 u
Formula C22H29NO6S
InChI InChI=1S/C22H29NO6S/c1-7-26-16-11-15(12-17(27-8-2)19(16)28-9-3)20(24)23-21-18(22(25)29-10-4)13(5)14(6)30-21/h11-12H,7-10H2,1-6H3,(H,23,24)
InChIKey HFFLHMCGYSCERT-UHFFFAOYSA-N
Molecular Weight 435.535 g/mol
SMILES N(C1=C(C(C)=C(S1)C)C(=O)OCC)C(C=1C=C(OCC)C(=C(C1)OCC)OCC)=O