4-(methylsulfamoyl)-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzamide

Systemtic Name: 4-(methylsulfamoyl)-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzamide Openeye Name: 4-(methylsulfamoyl)-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzamide CAS Name: 4-(methylsulfamoyl)-N-[2-oxo-2-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]ethyl]benzamide IUPAC Name: 4-(methylsulfamoyl)-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzamide Traditional Name: N-[2-keto-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]-4-(methylsulfamoyl)benzamide Formula: C22H29N4O5S+ MolecularWeight: 461.55446

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O5S/c1-23-32(29,30)20-9-7-18(8-10-20)22(28)24-17-21(27)26-13-11-25(12-14-26)15-16-31-19-5-3-2-4-6-19/h2-10,23H,11-17H2,1H3,(H,24,28)/p+1