(5-carbamothioyl-2-fluoranyl-phenyl)methyl-diethyl-azanium

Systemtic Name: (5-carbamothioyl-2-fluoranyl-phenyl)methyl-diethyl-azanium Openeye Name: (5-carbamothioyl-2-fluoro-phenyl)methyl-diethyl-ammonium CAS Name: (5-carbamothioyl-2-fluorophenyl)methyl-diethylammonium IUPAC Name: (5-carbamothioyl-2-fluorophenyl)methyl-diethylazanium Traditional Name: diethyl-(2-fluoro-5-thiocarbamoyl-benzyl)ammonium Formula: C12H18FN2S+ MolecularWeight: 241.348123

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C12H17FN2S/c1-3-15(4-2)8-10-7-9(12(14)16)5-6-11(10)13/h5-7H,3-4,8H2,1-2H3,(H2,14,16)/p+1