3-[2-(5-fluoranyl-1H-indol-3-yl)ethylcarbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(5-fluoranyl-1H-indol-3-yl)ethylcarbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[2-(5-fluoro-1H-indol-3-yl)ethylcarbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-(5-fluoro-1H-indol-3-yl)ethylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[2-(5-fluoro-1H-indol-3-yl)ethylcarbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[2-(5-fluoro-1H-indol-3-yl)ethylthiocarbamoylamino]propyl-dimethyl-ammonium Formula: C16H24FN4S+ MolecularWeight: 323.451963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NCCC1=CNC2=C1C=C(C=C2)F

Isomeric SMILES

C[NH+](C)CCCNC(=S)NCCC1=CNC2=C1C=C(C=C2)F

InChI

InChI=1S/C16H23FN4S/c1-21(2)9-3-7-18-16(22)19-8-6-12-11-20-15-5-4-13(17)10-14(12)15/h4-5,10-11,20H,3,6-9H2,1-2H3,(H2,18,19,22)/p+1