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ethyl 4-(4-methoxyphenyl)-5-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-thiophenecarboxylate

View entire compound with spectra: 2 NMR

ethyl 4-(4-methoxyphenyl)-5-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-thiophenecarboxylate
SpectraBase Compound ID FuSaLcUcEct
InChI InChI=1S/C25H21NO6S/c1-4-31-25(29)21-20(15-9-11-17(30-3)12-10-15)14(2)33-23(21)26-22(27)18-13-16-7-5-6-8-19(16)32-24(18)28/h5-13H,4H2,1-3H3,(H,26,27)
InChIKey FXYJWAWDJNUFNA-UHFFFAOYSA-N
Mol Weight 463.5 g/mol
Molecular Formula C25H21NO6S
Exact Mass 463.108959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71Yln5R3RgX
Name Ethyl 4-(4-methoxyphenyl)-5-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.108958568 u
Formula C25H21NO6S
InChI InChI=1S/C25H21NO6S/c1-4-31-25(29)21-20(15-9-11-17(30-3)12-10-15)14(2)33-23(21)26-22(27)18-13-16-7-5-6-8-19(16)32-24(18)28/h5-13H,4H2,1-3H3,(H,26,27)
InChIKey FXYJWAWDJNUFNA-UHFFFAOYSA-N
Molecular Weight 463.504 g/mol
SMILES N(C1=C(C(=C(C)S1)C=1C=CC(=CC1)OC)C(=O)OCC)C(C=1C(OC=2C(C1)=CC=CC2)=O)=O