(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-methyl-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-methyl-[2-oxo-2-[2-(phenylthio)ethylamino]ethyl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-methyl-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-[2-keto-2-[2-(phenylthio)ethylamino]ethyl]-methyl-ammonium Formula: C18H21ClFN2OS+ MolecularWeight: 367.888543

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC=C1Cl)F)CC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

C[NH+](CC1=C(C=CC=C1Cl)F)CC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C18H20ClFN2OS/c1-22(12-15-16(19)8-5-9-17(15)20)13-18(23)21-10-11-24-14-6-3-2-4-7-14/h2-9H,10-13H2,1H3,(H,21,23)/p+1