(4-carbamothioyl-2-fluoranyl-phenyl)methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: (4-carbamothioyl-2-fluoranyl-phenyl)methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(4-carbamothioyl-2-fluoro-phenyl)methyl]-ethyl-ammonium CAS Name: (4-carbamothioyl-2-fluorophenyl)methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(4-carbamothioyl-2-fluorophenyl)methyl]-ethylazanium Traditional Name: benzyl-ethyl-(2-fluoro-4-thiocarbamoyl-benzyl)ammonium Formula: C17H20FN2S+ MolecularWeight: 303.417503

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=S)N)F

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=S)N)F

InChI

InChI=1S/C17H19FN2S/c1-2-20(11-13-6-4-3-5-7-13)12-15-9-8-14(17(19)21)10-16(15)18/h3-10H,2,11-12H2,1H3,(H2,19,21)/p+1