2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-5-nitro-anilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C20H20N6O7S2 MolecularWeight: 520.5388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)C

InChI

InChI=1S/C20H20N6O7S2/c1-14-4-7-16(26(28)29)12-18(14)25(34(2,30)31)13-19(27)23-15-5-8-17(9-6-15)35(32,33)24-20-21-10-3-11-22-20/h3-12H,13H2,1-2H3,(H,23,27)(H,21,22,24)