(4-methylsulfanylphenyl)methyl 5-(diethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 5-(diethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 5-(diethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(diethylsulfamoyl)-2-fluorobenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 5-(diethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(diethylsulfamoyl)-2-fluoro-benzoic acid [4-(methylthio)benzyl] ester Formula: C19H22FNO4S2 MolecularWeight: 411.510683

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H22FNO4S2/c1-4-21(5-2)27(23,24)16-10-11-18(20)17(12-16)19(22)25-13-14-6-8-15(26-3)9-7-14/h6-12H,4-5,13H2,1-3H3