3,5-dimethyl-1-phenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-1-phenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-4-sulfonamide Openeye Name: 3,5-dimethyl-1-phenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-4-sulfonamide CAS Name: 3,5-dimethyl-1-phenyl-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-4-pyrazolesulfonamide IUPAC Name: 3,5-dimethyl-1-phenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-4-sulfonamide Traditional Name: 3,5-dimethyl-1-phenyl-N-[4-(2-pyrimidylsulfamoyl)phenyl]pyrazole-4-sulfonamide Formula: C21H20N6O4S2 MolecularWeight: 484.5513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C21H20N6O4S2/c1-15-20(16(2)27(24-15)18-7-4-3-5-8-18)33(30,31)25-17-9-11-19(12-10-17)32(28,29)26-21-22-13-6-14-23-21/h3-14,25H,1-2H3,(H,22,23,26)