[(2S)-1-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-phenyl-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-1-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-phenyl-propan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-1-benzyl-2-[[3-(diethylsulfamoyl)benzoyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(2S)-1-[[[3-(diethylsulfamoyl)phenyl]-oxomethyl]amino]-3-phenylpropan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-[[3-(diethylsulfamoyl)benzoyl]amino]-3-phenylpropan-2-yl]-dimethylazanium Traditional Name: [(1S)-1-benzyl-2-[[3-(diethylsulfamoyl)benzoyl]amino]ethyl]-dimethyl-ammonium Formula: C22H32N3O3S+ MolecularWeight: 418.57278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC(CC2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC[C@H](CC2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C22H31N3O3S/c1-5-25(6-2)29(27,28)21-14-10-13-19(16-21)22(26)23-17-20(24(3)4)15-18-11-8-7-9-12-18/h7-14,16,20H,5-6,15,17H2,1-4H3,(H,23,26)/p+1/t20-/m0/s1