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

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-fluorophenyl)methylcarbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-fluorophenyl)methylcarbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(4-fluorobenzyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C12H19FN3S+ MolecularWeight: 256.362763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCC1=CC=C(C=C1)F

Isomeric SMILES

C[NH+](C)CCNC(=S)NCC1=CC=C(C=C1)F

InChI

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