2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-(diethylsulfamoyl)-2-methoxyanilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H29N4O3S2+ MolecularWeight: 389.55646

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=S)NCC[NH+](C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C16H28N4O3S2/c1-6-20(7-2)25(21,22)13-8-9-15(23-5)14(12-13)18-16(24)17-10-11-19(3)4/h8-9,12H,6-7,10-11H2,1-5H3,(H2,17,18,24)/p+1