N-(3-bromophenyl)-2-[(4-fluorophenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[(4-fluorophenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-bromophenyl)-2-(4-fluoro-N-(2-methoxy-5-methyl-phenyl)sulfonyl-anilino)acetamide CAS Name: N-(3-bromophenyl)-2-(4-fluoro-N-(2-methoxy-5-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-bromophenyl)-2-(4-fluoro-N-(2-methoxy-5-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-(3-bromophenyl)-2-(4-fluoro-N-(2-methoxy-5-methyl-phenyl)sulfonyl-anilino)acetamide Formula: C22H20BrFN2O4S MolecularWeight: 507.372603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC(=O)NC2=CC(=CC=C2)Br)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC(=O)NC2=CC(=CC=C2)Br)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H20BrFN2O4S/c1-15-6-11-20(30-2)21(12-15)31(28,29)26(19-9-7-17(24)8-10-19)14-22(27)25-18-5-3-4-16(23)13-18/h3-13H,14H2,1-2H3,(H,25,27)