2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C21H23N5O5S2 MolecularWeight: 489.56782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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