[(1S)-2-[[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[3-[(4-bromophenyl)sulfonylamino]benzoyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[3-[(4-bromophenyl)sulfonylamino]phenyl]-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[3-[(4-bromophenyl)sulfonylamino]benzoyl]amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[[3-(brosylamino)benzoyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C23H25BrN3O3S+ MolecularWeight: 503.4319

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C23H24BrN3O3S/c1-27(2)22(17-7-4-3-5-8-17)16-25-23(28)18-9-6-10-20(15-18)26-31(29,30)21-13-11-19(24)12-14-21/h3-15,22,26H,16H2,1-2H3,(H,25,28)/p+1/t22-/m1/s1