2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C20H20BrN5O5S2 MolecularWeight: 554.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)C)Br

InChI

InChI=1S/C20H20BrN5O5S2/c1-14-12-16(6-9-18(14)21)26(32(2,28)29)13-19(27)24-15-4-7-17(8-5-15)33(30,31)25-20-22-10-3-11-23-20/h3-12H,13H2,1-2H3,(H,24,27)(H,22,23,25)