ethyl 4-[[(4-bromophenyl)methyl-(4-fluoranyl-3-methyl-phenyl)sulfonyl-amino]methyl]benzoate

Systemtic Name: ethyl 4-[[(4-bromophenyl)methyl-(4-fluoranyl-3-methyl-phenyl)sulfonyl-amino]methyl]benzoate Openeye Name: ethyl 4-[[(4-bromophenyl)methyl-(4-fluoro-3-methyl-phenyl)sulfonyl-amino]methyl]benzoate CAS Name: 4-[[(4-bromophenyl)methyl-(4-fluoro-3-methylphenyl)sulfonylamino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(4-bromophenyl)methyl-(4-fluoro-3-methylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-bromobenzyl)-(4-fluoro-3-methyl-phenyl)sulfonyl-amino]methyl]benzoic acid ethyl ester Formula: C24H23BrFNO4S MolecularWeight: 520.411123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)F)C

InChI

InChI=1S/C24H23BrFNO4S/c1-3-31-24(28)20-8-4-18(5-9-20)15-27(16-19-6-10-21(25)11-7-19)32(29,30)22-12-13-23(26)17(2)14-22/h4-14H,3,15-16H2,1-2H3