3-[[4-[(4-fluorophenyl)sulfamoyl]phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[4-[(4-fluorophenyl)sulfamoyl]phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[4-[(4-fluorophenyl)sulfamoyl]benzoyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[4-[(4-fluorophenyl)sulfamoyl]phenyl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[4-[(4-fluorophenyl)sulfamoyl]benzoyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[4-[(4-fluorophenyl)sulfamoyl]benzoyl]amino]propyl]-methyl-ammonium Formula: C24H27FN3O3S+ MolecularWeight: 456.552883

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)F)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)F)CC3=CC=CC=C3

InChI

InChI=1S/C24H26FN3O3S/c1-28(18-19-6-3-2-4-7-19)17-5-16-26-24(29)20-8-14-23(15-9-20)32(30,31)27-22-12-10-21(25)11-13-22/h2-4,6-15,27H,5,16-18H2,1H3,(H,26,29)/p+1