5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]pyrazol-1-ium-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]pyrazol-1-ium-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]pyrazol-1-ium-3-carboxamide CAS Name: 5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]-3-pyrazol-1-iumcarboxamide IUPAC Name: 5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]pyrazol-1-ium-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-1-ethyl-N-methyl-1-[2-(4-sulfamoylphenyl)phenyl]pyrazol-1-ium-3-carboxamide Formula: C25H24ClN4O3S+ MolecularWeight: 496.00106

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=CC(=N1)C(=O)NC)C2=CC=C(C=C2)Cl)C3=CC=CC=C3C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC[N+]1(C(=CC(=N1)C(=O)NC)C2=CC=C(C=C2)Cl)C3=CC=CC=C3C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H23ClN4O3S/c1-3-30(24(16-22(29-30)25(31)28-2)18-8-12-19(26)13-9-18)23-7-5-4-6-21(23)17-10-14-20(15-11-17)34(27,32)33/h4-16H,3H2,1-2H3,(H2-,27,28,31,32,33)/p+1