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2-[2-(4-bromophenyl)sulfanylethylcarbamothioylamino]ethyl-dimethyl-azanium

2-[2-(4-bromophenyl)sulfanylethylcarbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name:2-[2-(4-bromophenyl)sulfanylethylcarbamothioylamino]ethyl-dimethyl-azanium
Openeye Name:2-[2-(4-bromophenyl)sulfanylethylcarbamothioylamino]ethyl-dimethyl-ammonium
CAS Name:2-[[[2-[(4-bromophenyl)thio]ethylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium
IUPAC Name:2-[2-(4-bromophenyl)sulfanylethylcarbamothioylamino]ethyl-dimethylazanium
Traditional Name:2-[2-[(4-bromophenyl)thio]ethylthiocarbamoylamino]ethyl-dimethyl-ammonium
Formula: C13H21BrN3S2+
MolecularWeight: 363.35994
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCCSC1=CC=C(C=C1)Br


Isomeric SMILES

C[NH+](C)CCNC(=S)NCCSC1=CC=C(C=C1)Br


InChI

InChI=1S/C13H20BrN3S2/c1-17(2)9-7-15-13(18)16-8-10-19-12-5-3-11(14)4-6-12/h3-6H,7-10H2,1-2H3,(H2,15,16,18)/p+1


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