N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]cyclobutanecarboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]cyclobutanecarboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]cyclobutanecarboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-methyl-1-piperazin-4-iumyl)phenyl]cyclobutanecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]cyclobutanecarboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]cyclobutanecarboxamide Formula: C20H33N4O3S+ MolecularWeight: 409.56602

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)C)NC(=O)C3CCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)C)NC(=O)C3CCC3

InChI

InChI=1S/C20H32N4O3S/c1-4-24(5-2)28(26,27)17-9-10-19(23-13-11-22(3)12-14-23)18(15-17)21-20(25)16-7-6-8-16/h9-10,15-16H,4-8,11-14H2,1-3H3,(H,21,25)/p+1