3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]propyl-diethyl-azanium Openeye Name: 3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]propyl-diethyl-ammonium CAS Name: 3-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]propyl-diethylazanium Traditional Name: 3-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoylamino]propyl-diethyl-ammonium Formula: C16H29N4O2S2+ MolecularWeight: 373.55706

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N(C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N(C)C

InChI

InChI=1S/C16H28N4O2S2/c1-5-20(6-2)12-8-11-17-16(23)18-14-9-7-10-15(13-14)24(21,22)19(3)4/h7,9-10,13H,5-6,8,11-12H2,1-4H3,(H2,17,18,23)/p+1