3-[(3-fluorophenyl)carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-fluorophenyl)carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(3-fluorophenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(3-fluoroanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(3-fluorophenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(3-fluorophenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C12H19FN3S+ MolecularWeight: 256.362763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=CC(=CC=C1)F

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=CC(=CC=C1)F

InChI

InChI=1S/C12H18FN3S/c1-16(2)8-4-7-14-12(17)15-11-6-3-5-10(13)9-11/h3,5-6,9H,4,7-8H2,1-2H3,(H2,14,15,17)/p+1