N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxy-anilino]-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-(N-besyl-3,4-dimethoxy-anilino)-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C22H20BrFN2O5S MolecularWeight: 523.372003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)NC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)NC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H20BrFN2O5S/c1-30-20-11-9-16(13-21(20)31-2)26(32(28,29)17-6-4-3-5-7-17)14-22(27)25-19-10-8-15(23)12-18(19)24/h3-13H,14H2,1-2H3,(H,25,27)