2-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzyl-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]-(phenylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzyl-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C20H29N4O2S2+ MolecularWeight: 421.59986

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

C[NH+](C)CCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H28N4O2S2/c1-22(2)13-14-24(16-17-9-6-5-7-10-17)20(27)21-18-11-8-12-19(15-18)28(25,26)23(3)4/h5-12,15H,13-14,16H2,1-4H3,(H,21,27)/p+1