4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]butyramide Formula: C23H27N5O5S2 MolecularWeight: 517.62098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O5S2/c1-17-7-8-18(2)21(16-17)28(34(3,30)31)15-4-6-22(29)26-19-9-11-20(12-10-19)35(32,33)27-23-24-13-5-14-25-23/h5,7-14,16H,4,6,15H2,1-3H3,(H,26,29)(H,24,25,27)