3-[[(4-chlorophenyl)amino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-chlorophenyl)amino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-chloroanilino)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[(4-chlorophenyl)hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-chloroanilino)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(4-chloroanilino)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C12H20ClN4S+ MolecularWeight: 287.832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NNC1=CC=C(C=C1)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NNC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H19ClN4S/c1-17(2)9-3-8-14-12(18)16-15-11-6-4-10(13)5-7-11/h4-7,15H,3,8-9H2,1-2H3,(H2,14,16,18)/p+1