(4-fluorophenyl)methyl-methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]azanium

Systemtic Name: (4-fluorophenyl)methyl-methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]azanium Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl]-[(4-fluorophenyl)methyl]-methyl-ammonium CAS Name: (4-fluorophenyl)methyl-methyl-[2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-methyl-[2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl]azanium Traditional Name: [2-[2-(allylthio)anilino]-2-keto-ethyl]-(4-fluorobenzyl)-methyl-ammonium Formula: C19H22FN2OS+ MolecularWeight: 345.454183

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)F)CC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)F)CC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C19H21FN2OS/c1-3-12-24-18-7-5-4-6-17(18)21-19(23)14-22(2)13-15-8-10-16(20)11-9-15/h3-11H,1,12-14H2,2H3,(H,21,23)/p+1