[(2R)-1-oxidanylidene-1-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]propan-2-yl] 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]propan-2-yl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [(2R)-1-oxo-1-[4-(2-pyrimidinylsulfamoyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[4-(pyrimidin-2-ylsulfamoyl)anilino]propan-2-yl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [(1R)-2-keto-1-methyl-2-[4-(2-pyrimidylsulfamoyl)anilino]ethyl] ester Formula: C21H19FN4O6S MolecularWeight: 474.462163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)OC(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)OC(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H19FN4O6S/c1-13(32-20(28)14-4-9-18(31-2)17(22)12-14)19(27)25-15-5-7-16(8-6-15)33(29,30)26-21-23-10-3-11-24-21/h3-13H,1-2H3,(H,25,27)(H,23,24,26)/t13-/m1/s1