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Ethyl 2-({[4-(acetylamino)phenyl]sulfonyl}amino)-4-(4-methoxyphenyl)-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID HmC57yRNC7y
InChI InChI=1S/C23H24N2O6S2/c1-5-31-23(27)21-20(16-6-10-18(30-4)11-7-16)14(2)32-22(21)25-33(28,29)19-12-8-17(9-13-19)24-15(3)26/h6-13,25H,5H2,1-4H3,(H,24,26)
InChIKey GJYMRPRAEJAUIN-UHFFFAOYSA-N
Mol Weight 488.57 g/mol
Molecular Formula C23H24N2O6S2
Exact Mass 488.107579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVTuIrf5anA
Name Ethyl 2-({[4-(acetylamino)phenyl]sulfonyl}amino)-4-(4-methoxyphenyl)-5-methyl-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 488.107578843 u
Formula C23H24N2O6S2
InChI InChI=1S/C23H24N2O6S2/c1-5-31-23(27)21-20(16-6-10-18(30-4)11-7-16)14(2)32-22(21)25-33(28,29)19-12-8-17(9-13-19)24-15(3)26/h6-13,25H,5H2,1-4H3,(H,24,26)
InChIKey GJYMRPRAEJAUIN-UHFFFAOYSA-N
Molecular Weight 488.573 g/mol
SMILES N(C1=C(C(=C(C)S1)C=1C=CC(=CC1)OC)C(=O)OCC)S(C=1C=CC(NC(=O)C)=CC1)(=O)=O