2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidino-benzoyl]amino]ethyl-diisopropyl-ammonium Formula: C21H37N4O3S+ MolecularWeight: 425.60848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)N2CCCC2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)N2CCCC2)C(C)C

InChI

InChI=1S/C21H36N4O3S/c1-16(2)25(17(3)4)14-11-22-21(26)19-15-18(29(27,28)23(5)6)9-10-20(19)24-12-7-8-13-24/h9-10,15-17H,7-8,11-14H2,1-6H3,(H,22,26)/p+1