5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-[(4-fluorophenyl)methylthio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-[(4-fluorobenzyl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]pyrimidine-4-carboxamide Formula: C22H16ClFN6O3S2 MolecularWeight: 530.982243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H16ClFN6O3S2/c23-18-12-27-22(34-13-14-2-4-15(24)5-3-14)29-19(18)20(31)28-16-6-8-17(9-7-16)35(32,33)30-21-25-10-1-11-26-21/h1-12H,13H2,(H,28,31)(H,25,26,30)