N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-2-methylsulfonyl-aniline

Systemtic Name: N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-2-methylsulfonyl-aniline Openeye Name: N-[(4-bromo-2-fluoro-phenyl)methyl]-2-methylsulfonyl-aniline CAS Name: N-[(4-bromo-2-fluorophenyl)methyl]-2-methylsulfonylaniline IUPAC Name: N-[(4-bromo-2-fluorophenyl)methyl]-2-methylsulfonylaniline Traditional Name: (4-bromo-2-fluoro-benzyl)-(2-mesylphenyl)amine Formula: C14H13BrFNO2S MolecularWeight: 358.225923

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H13BrFNO2S/c1-20(18,19)14-5-3-2-4-13(14)17-9-10-6-7-11(15)8-12(10)16/h2-8,17H,9H2,1H3