2-[[3-[(3-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-[(3-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-[(3-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-[(3-chlorophenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-[(3-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[3-[(3-chlorophenyl)sulfamoyl]phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H22ClN4O2S2+ MolecularWeight: 413.96518

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H21ClN4O2S2/c1-22(2)10-9-19-17(25)20-14-6-4-8-16(12-14)26(23,24)21-15-7-3-5-13(18)11-15/h3-8,11-12,21H,9-10H2,1-2H3,(H2,19,20,25)/p+1