N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-[4-(diethylsulfamoyl)benzyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C21H23N5O5S MolecularWeight: 457.50282

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O5S/c1-3-24(4-2)32(30,31)20-11-5-16(6-12-20)13-22-21(27)17-14-23-25(15-17)18-7-9-19(10-8-18)26(28)29/h5-12,14-15H,3-4,13H2,1-2H3,(H,22,27)