2,5-dimethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[4-(2-pyrimidinylsulfamoyl)phenyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[4-(2-pyrimidylsulfamoyl)phenyl]benzenesulfonamide Formula: C18H18N4O4S2 MolecularWeight: 418.48992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4S2/c1-13-4-5-14(2)17(12-13)28(25,26)21-15-6-8-16(9-7-15)27(23,24)22-18-19-10-3-11-20-18/h3-12,21H,1-2H3,(H,19,20,22)