[(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromanyl-2-fluoranyl-phenyl)ethyl]azanium

Systemtic Name: [(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromanyl-2-fluoranyl-phenyl)ethyl]azanium Openeye Name: [(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromo-2-fluoro-phenyl)ethyl]ammonium CAS Name: [(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromo-2-fluorophenyl)ethyl]ammonium IUPAC Name: [(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromo-2-fluorophenyl)ethyl]azanium Traditional Name: [(1R)-2-(1,3-benzothiazol-2-yl)-1-(5-bromo-2-fluoro-phenyl)ethyl]ammonium Formula: C15H13BrFN2S+ MolecularWeight: 352.244523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CC(C3=C(C=CC(=C3)Br)F)[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C[C@H](C3=C(C=CC(=C3)Br)F)[NH3+]

InChI

InChI=1S/C15H12BrFN2S/c16-9-5-6-11(17)10(7-9)12(18)8-15-19-13-3-1-2-4-14(13)20-15/h1-7,12H,8,18H2/p+1/t12-/m1/s1