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Methyl 4-(4-tert-butylphenyl)-2-[(4-methoxybenzoyl)amino]-3-thiophenecarboxylate
SpectraBase Compound ID F893JpprfR7
InChI InChI=1S/C24H25NO4S/c1-24(2,3)17-10-6-15(7-11-17)19-14-30-22(20(19)23(27)29-5)25-21(26)16-8-12-18(28-4)13-9-16/h6-14H,1-5H3,(H,25,26)
InChIKey LVCIIOVVCCRASN-UHFFFAOYSA-N
Mol Weight 423.53 g/mol
Molecular Formula C24H25NO4S
Exact Mass 423.150429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7nIFOa5bKZX
Name Methyl 4-(4-tert-butylphenyl)-2-[(4-methoxybenzoyl)amino]-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 423.150429459 u
Formula C24H25NO4S
InChI InChI=1S/C24H25NO4S/c1-24(2,3)17-10-6-15(7-11-17)19-14-30-22(20(19)23(27)29-5)25-21(26)16-8-12-18(28-4)13-9-16/h6-14H,1-5H3,(H,25,26)
InChIKey LVCIIOVVCCRASN-UHFFFAOYSA-N
Molecular Weight 423.527 g/mol
SMILES N(C1=C(C(=CS1)C1=CC=C(C(C)(C)C)C=C1)C(=O)OC)C(C=1C=CC(=CC1)OC)=O