[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-chloro-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C21H24ClFN2O5S MolecularWeight: 470.942063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)F)Cl

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C21H24ClFN2O5S/c1-14(2)10-11-24-20(26)13-30-21(27)18-12-17(8-9-19(18)22)31(28,29)25(3)16-6-4-15(23)5-7-16/h4-9,12,14H,10-11,13H2,1-3H3,(H,24,26)