4-[bis(fluoranyl)methylsulfanyl]-N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]aniline Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-4-(difluoromethylsulfanyl)aniline CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-(difluoromethylthio)aniline IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-(difluoromethylsulfanyl)aniline Traditional Name: (3-bromo-4-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=CC(=C(C=C2)F)Br)SC(F)F

Isomeric SMILES

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

InChI

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