[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(methylsulfamoyl)benzoate

Systemtic Name: [(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(methylsulfamoyl)benzoate Openeye Name: [(1S)-1-[(4-fluorophenyl)carbamoyl]propyl] 4-(methylsulfamoyl)benzoate CAS Name: 4-(methylsulfamoyl)benzoic acid [(2S)-1-(4-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-(4-fluoroanilino)-1-oxobutan-2-yl] 4-(methylsulfamoyl)benzoate Traditional Name: 4-(methylsulfamoyl)benzoic acid [(1S)-1-[(4-fluorophenyl)carbamoyl]propyl] ester Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)S(=O)(=O)NC

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)S(=O)(=O)NC

InChI

InChI=1S/C18H19FN2O5S/c1-3-16(17(22)21-14-8-6-13(19)7-9-14)26-18(23)12-4-10-15(11-5-12)27(24,25)20-2/h4-11,16,20H,3H2,1-2H3,(H,21,22)/t16-/m0/s1