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

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]propanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]propionamide Formula: C21H23N5O5S2 MolecularWeight: 489.56782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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