3-[[4-azanyl-3,5-bis(chloranyl)phenyl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-azanyl-3,5-bis(chloranyl)phenyl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-amino-3,5-dichloro-phenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-amino-3,5-dichloroanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-amino-3,5-dichlorophenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(4-amino-3,5-dichloro-phenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C12H19Cl2N4S+ MolecularWeight: 322.27706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18Cl2N4S/c1-18(2)5-3-4-16-12(19)17-8-6-9(13)11(15)10(14)7-8/h6-7H,3-5,15H2,1-2H3,(H2,16,17,19)/p+1