2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Formula: C22H24BrN5O5S2 MolecularWeight: 582.49046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC(=C(C=C3)Br)C)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC(=C(C=C3)Br)C)S(=O)(=O)C)C

InChI

InChI=1S/C22H24BrN5O5S2/c1-14-11-18(7-10-20(14)23)28(34(4,30)31)13-21(29)26-17-5-8-19(9-6-17)35(32,33)27-22-24-15(2)12-16(3)25-22/h5-12H,13H2,1-4H3,(H,26,29)(H,24,25,27)