2-[4-[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[[2-chloro-5-(dimethylsulfamoyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C22H28ClN4O4S+ MolecularWeight: 480.00012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C22H27ClN4O4S/c1-16-4-6-17(7-5-16)24-21(28)15-26-10-12-27(13-11-26)22(29)19-14-18(8-9-20(19)23)32(30,31)25(2)3/h4-9,14H,10-13,15H2,1-3H3,(H,24,28)/p+1