2-[4-[4-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[4-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[4-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[[4-(dimethylsulfamoyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[4-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[4-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C18H29N4O4S+ MolecularWeight: 397.51226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O4S/c1-14(2)19-17(23)13-21-9-11-22(12-10-21)18(24)15-5-7-16(8-6-15)27(25,26)20(3)4/h5-8,14H,9-13H2,1-4H3,(H,19,23)/p+1