[1-[(4-tert-butylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-fluoranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: [1-[(4-tert-butylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-fluoranyl-5-(methylsulfamoyl)benzoate Openeye Name: [2-(4-tert-butylanilino)-1-methyl-2-oxo-ethyl] 2-fluoro-5-(methylsulfamoyl)benzoate CAS Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [1-(4-tert-butylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-tert-butylanilino)-1-oxopropan-2-yl] 2-fluoro-5-(methylsulfamoyl)benzoate Traditional Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [2-(4-tert-butylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H25FN2O5S MolecularWeight: 436.497003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O5S/c1-13(19(25)24-15-8-6-14(7-9-15)21(2,3)4)29-20(26)17-12-16(10-11-18(17)22)30(27,28)23-5/h6-13,23H,1-5H3,(H,24,25)