N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-methylsulfonyl-piperidin-4-amine

Systemtic Name: N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-methylsulfonyl-piperidin-4-amine Openeye Name: N-[(4-bromo-2-fluoro-phenyl)methyl]-1-methylsulfonyl-piperidin-4-amine CAS Name: N-[(4-bromo-2-fluorophenyl)methyl]-1-methylsulfonyl-4-piperidinamine IUPAC Name: N-[(4-bromo-2-fluorophenyl)methyl]-1-methylsulfonylpiperidin-4-amine Traditional Name: (4-bromo-2-fluoro-benzyl)-(1-mesyl-4-piperidyl)amine Formula: C13H18BrFN2O2S MolecularWeight: 365.261623

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H18BrFN2O2S/c1-20(18,19)17-6-4-12(5-7-17)16-9-10-2-3-11(14)8-13(10)15/h2-3,8,12,16H,4-7,9H2,1H3