3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 3-cyano-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C24H32N5O3S+ MolecularWeight: 470.60758

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H31N5O3S/c1-4-27-12-14-28(15-13-27)23-11-10-21(33(31,32)29(5-2)6-3)17-22(23)26-24(30)20-9-7-8-19(16-20)18-25/h7-11,16-17H,4-6,12-15H2,1-3H3,(H,26,30)/p+1