1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[4-(2-pyrimidylsulfamoyl)phenyl]pyrazole-3-carboxamide Formula: C21H16ClN7O6S MolecularWeight: 529.91304

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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=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClN7O6S/c22-17-12-15(29(31)32)4-7-19(17)35-13-28-11-8-18(26-28)20(30)25-14-2-5-16(6-3-14)36(33,34)27-21-23-9-1-10-24-21/h1-12H,13H2,(H,25,30)(H,23,24,27)