ethyl 2-[2-[2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)-1-oxobutoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanylbutanoyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)butanoyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C22H25ClN2O7S2 MolecularWeight: 529.0261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H25ClN2O7S2/c1-3-31-21(27)17-6-4-5-7-18(17)24-20(26)14-32-22(28)19(12-13-33-2)25-34(29,30)16-10-8-15(23)9-11-16/h4-11,19,25H,3,12-14H2,1-2H3,(H,24,26)