3-(diethylsulfamoyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 3-(diethylsulfamoyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 3-(diethylsulfamoyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 3-(diethylsulfamoyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-(diethylsulfamoyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 3-(diethylsulfamoyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C22H31N4O3S+ MolecularWeight: 431.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C22H30N4O3S/c1-4-26(5-2)30(28,29)21-8-6-7-18(17-21)22(27)23-19-9-11-20(12-10-19)25-15-13-24(3)14-16-25/h6-12,17H,4-5,13-16H2,1-3H3,(H,23,27)/p+1