2-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]ethylazanium

Systemtic Name: 2-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]ethylazanium Openeye Name: 2-[(5-bromo-2-fluoro-phenyl)methylsulfanyl]ethylammonium CAS Name: 2-[(5-bromo-2-fluorophenyl)methylthio]ethylammonium IUPAC Name: 2-[(5-bromo-2-fluorophenyl)methylsulfanyl]ethylazanium Traditional Name: 2-[(5-bromo-2-fluoro-benzyl)thio]ethylammonium Formula: C9H12BrFNS+ MolecularWeight: 265.165683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CSCC[NH3+])F

Isomeric SMILES

C1=CC(=C(C=C1Br)CSCC[NH3+])F

InChI

InChI=1S/C9H11BrFNS/c10-8-1-2-9(11)7(5-8)6-13-4-3-12/h1-2,5H,3-4,6,12H2/p+1