4-[bis(fluoranyl)methylsulfanyl]-N-[(5-bromanylthiophen-3-yl)methyl]aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-[(5-bromanylthiophen-3-yl)methyl]aniline Openeye Name: N-[(5-bromo-3-thienyl)methyl]-4-(difluoromethylsulfanyl)aniline CAS Name: N-[(5-bromo-3-thiophenyl)methyl]-4-(difluoromethylthio)aniline IUPAC Name: N-[(5-bromothiophen-3-yl)methyl]-4-(difluoromethylsulfanyl)aniline Traditional Name: (5-bromo-3-thienyl)methyl-[4-(difluoromethylthio)phenyl]amine Formula: C12H10BrF2NS2 MolecularWeight: 350.245306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10BrF2NS2/c13-11-5-8(7-17-11)6-16-9-1-3-10(4-2-9)18-12(14)15/h1-5,7,12,16H,6H2