3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-[(4-chlorophenyl)thio]ethylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[2-[(4-chlorophenyl)thio]ethylthiocarbamoylamino]propyl-dimethyl-ammonium Formula: C14H23ClN3S2+ MolecularWeight: 332.93552

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H22ClN3S2/c1-18(2)10-3-8-16-14(19)17-9-11-20-13-6-4-12(15)5-7-13/h4-7H,3,8-11H2,1-2H3,(H2,16,17,19)/p+1