4-bromanyl-5-[(3-chloranyl-4-fluoranyl-phenyl)methylsulfamoyl]-2-(1-phenylbutylamino)benzoic acid

Systemtic Name: 4-bromanyl-5-[(3-chloranyl-4-fluoranyl-phenyl)methylsulfamoyl]-2-(1-phenylbutylamino)benzoic acid Openeye Name: 4-bromo-5-[(3-chloro-4-fluoro-phenyl)methylsulfamoyl]-2-(1-phenylbutylamino)benzoic acid CAS Name: 4-bromo-5-[(3-chloro-4-fluorophenyl)methylsulfamoyl]-2-(1-phenylbutylamino)benzoic acid IUPAC Name: 4-bromo-5-[(3-chloro-4-fluorophenyl)methylsulfamoyl]-2-(1-phenylbutylamino)benzoic acid Traditional Name: 4-bromo-5-[(3-chloro-4-fluoro-benzyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid Formula: C24H23BrClFN2O4S MolecularWeight: 569.870823

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=CC(=C(C=C2C(=O)O)S(=O)(=O)NCC3=CC(=C(C=C3)F)Cl)Br

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=CC(=C(C=C2C(=O)O)S(=O)(=O)NCC3=CC(=C(C=C3)F)Cl)Br

InChI

InChI=1S/C24H23BrClFN2O4S/c1-2-6-21(16-7-4-3-5-8-16)29-22-13-18(25)23(12-17(22)24(30)31)34(32,33)28-14-15-9-10-20(27)19(26)11-15/h3-5,7-13,21,28-29H,2,6,14H2,1H3,(H,30,31)