2-[2-(4-fluorophenyl)ethylcarbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-(4-fluorophenyl)ethylcarbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[2-(4-fluorophenyl)ethylcarbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-(4-fluorophenyl)ethylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[2-(4-fluorophenyl)ethylcarbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[2-(4-fluorophenyl)ethylthiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C13H21FN3S+ MolecularWeight: 270.389343

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCCC1=CC=C(C=C1)F

Isomeric SMILES

C[NH+](C)CCNC(=S)NCCC1=CC=C(C=C1)F

InChI

InChI=1S/C13H20FN3S/c1-17(2)10-9-16-13(18)15-8-7-11-3-5-12(14)6-4-11/h3-6H,7-10H2,1-2H3,(H2,15,16,18)/p+1