3-[(2,4-dichlorophenyl)methylcarbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2,4-dichlorophenyl)methylcarbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(2,4-dichlorophenyl)methylcarbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2,4-dichlorophenyl)methylcarbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(2,4-dichlorobenzyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C13H20Cl2N3S+ MolecularWeight: 321.289

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NCC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NCC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C13H19Cl2N3S/c1-18(2)7-3-6-16-13(19)17-9-10-4-5-11(14)8-12(10)15/h4-5,8H,3,6-7,9H2,1-2H3,(H2,16,17,19)/p+1