[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate Openeye Name: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 4-(2-furylmethylsulfamoyl)benzoate CAS Name: 4-(2-furanylmethylsulfamoyl)benzoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylanilino)-2-oxoethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(2-furfurylsulfamoyl)benzoic acid [2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H20N2O6S2/c1-30-19-7-3-2-6-18(19)23-20(24)14-29-21(25)15-8-10-17(11-9-15)31(26,27)22-13-16-5-4-12-28-16/h2-12,22H,13-14H2,1H3,(H,23,24)