2-[methylsulfonyl(phenyl)amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-[methylsulfonyl(phenyl)amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 2-(N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide CAS Name: 2-(N-methylsulfonylanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 2-(N-mesylanilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]butyramide Formula: C21H23N5O5S2 MolecularWeight: 489.56782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)N(C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)N(C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C21H23N5O5S2/c1-3-19(26(32(2,28)29)17-8-5-4-6-9-17)20(27)24-16-10-12-18(13-11-16)33(30,31)25-21-22-14-7-15-23-21/h4-15,19H,3H2,1-2H3,(H,24,27)(H,22,23,25)