4-[bis(fluoranyl)methylsulfonyl]-N-[1-(3-bromanylthiophen-2-yl)ethyl]aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfonyl]-N-[1-(3-bromanylthiophen-2-yl)ethyl]aniline Openeye Name: N-[1-(3-bromo-2-thienyl)ethyl]-4-(difluoromethylsulfonyl)aniline CAS Name: N-[1-(3-bromo-2-thiophenyl)ethyl]-4-(difluoromethylsulfonyl)aniline IUPAC Name: N-[1-(3-bromothiophen-2-yl)ethyl]-4-(difluoromethylsulfonyl)aniline Traditional Name: 1-(3-bromo-2-thienyl)ethyl-[4-(difluoromethylsulfonyl)phenyl]amine Formula: C13H12BrF2NO2S2 MolecularWeight: 396.270686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CS1)Br)NC2=CC=C(C=C2)S(=O)(=O)C(F)F

Isomeric SMILES

CC(C1=C(C=CS1)Br)NC2=CC=C(C=C2)S(=O)(=O)C(F)F

InChI

InChI=1S/C13H12BrF2NO2S2/c1-8(12-11(14)6-7-20-12)17-9-2-4-10(5-3-9)21(18,19)13(15)16/h2-8,13,17H,1H3