4-[bis(fluoranyl)methylsulfanyl]-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]aniline Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-4-(difluoromethylsulfanyl)aniline CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-(difluoromethylthio)aniline IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-(difluoromethylsulfanyl)aniline Traditional Name: (5-bromo-2-fluoro-benzyl)-[4-(difluoromethylthio)phenyl]amine Formula: C14H11BrF3NS MolecularWeight: 362.20805

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=C(C=CC(=C2)Br)F)SC(F)F

Isomeric SMILES

C1=CC(=CC=C1NCC2=C(C=CC(=C2)Br)F)SC(F)F

InChI

InChI=1S/C14H11BrF3NS/c15-10-1-6-13(16)9(7-10)8-19-11-2-4-12(5-3-11)20-14(17)18/h1-7,14,19H,8H2