(E)-3-(2-azanyl-5-bromanyl-phenyl)-N-[2-bromanyl-4-(2-sulfamoylphenyl)phenyl]-2-fluoranyl-but-2-enamide

Systemtic Name: (E)-3-(2-azanyl-5-bromanyl-phenyl)-N-[2-bromanyl-4-(2-sulfamoylphenyl)phenyl]-2-fluoranyl-but-2-enamide Openeye Name: (E)-3-(2-amino-5-bromo-phenyl)-N-[2-bromo-4-(2-sulfamoylphenyl)phenyl]-2-fluoro-but-2-enamide CAS Name: (E)-3-(2-amino-5-bromophenyl)-N-[2-bromo-4-(2-sulfamoylphenyl)phenyl]-2-fluoro-2-butenamide IUPAC Name: (E)-3-(2-amino-5-bromophenyl)-N-[2-bromo-4-(2-sulfamoylphenyl)phenyl]-2-fluorobut-2-enamide Traditional Name: (E)-3-(2-amino-5-bromo-phenyl)-N-[2-bromo-4-(2-sulfamoylphenyl)phenyl]-2-fluoro-but-2-enamide Formula: C22H18Br2FN3O3S MolecularWeight: 583.268023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)Br)F)C3=C(C=CC(=C3)Br)N

Isomeric SMILES

C/C(=C(/C(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)Br)\F)/C3=C(C=CC(=C3)Br)N

InChI

InChI=1S/C22H18Br2FN3O3S/c1-12(16-11-14(23)7-8-18(16)26)21(25)22(29)28-19-9-6-13(10-17(19)24)15-4-2-3-5-20(15)32(27,30)31/h2-11H,26H2,1H3,(H,28,29)(H2,27,30,31)/b21-12+