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3-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]-3-(p-tolyl)propionic acid ethyl ester
SpectraBase Compound ID vFBkdP6i3s
InChI InChI=1S/C22H24Cl2N2O5S/c1-3-31-21(27)12-19(14-6-4-13(2)5-7-14)25-22(28)16-10-20(18(24)11-17(16)23)32(29,30)26-15-8-9-15/h4-7,10-11,15,19,26H,3,8-9,12H2,1-2H3,(H,25,28)
InChIKey DXCIPDQNFCSPAD-UHFFFAOYSA-N
Mol Weight 499.41 g/mol
Molecular Formula C22H24Cl2N2O5S
Exact Mass 498.078298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AWgnfNulxgc
Name 3-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]-3-(p-tolyl)propionic acid ethyl ester
Alternate Name(s) 3-[[[2,4-dichloro-5-(cyclopropylsulfamoyl)phenyl]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid ethyl ester Ethyl 3-[[2,4-bis(chloranyl)-5-(cyclopropylsulfamoyl)phenyl]carbonylamino]-3-(4-methylphenyl)propanoate Ethyl 3-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]-3-(4-methylphenyl)propanoate Ethyl 3-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]-3-(p-tolyl)propanoate
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Formula C22H24Cl2N2O5S
InChI InChI=1S/C22H24Cl2N2O5S/c1-3-31-21(27)12-19(14-6-4-13(2)5-7-14)25-22(28)16-10-20(18(24)11-17(16)23)32(29,30)26-15-8-9-15/h4-7,10-11,15,19,26H,3,8-9,12H2,1-2H3,(H,25,28)
InChIKey DXCIPDQNFCSPAD-UHFFFAOYSA-N
Molecular Weight 499.409 g/mol
SMILES N(C(c1cc(S(NC2CC2)(=O)=O)c(cc1Cl)Cl)=O)C(CC(=O)OCC)c1ccc(cc1)C
SPLASH splash10-0a4i-5980000000-4dba920ae390d00caec6
Wiley ID 1512422