(4-bromanyl-6-fluoranyl-1,3-benzothiazol-2-yl)methylazanium

Systemtic Name: (4-bromanyl-6-fluoranyl-1,3-benzothiazol-2-yl)methylazanium Openeye Name: (4-bromo-6-fluoro-1,3-benzothiazol-2-yl)methylammonium CAS Name: (4-bromo-6-fluoro-1,3-benzothiazol-2-yl)methylammonium IUPAC Name: (4-bromo-6-fluoro-1,3-benzothiazol-2-yl)methylazanium Traditional Name: (4-bromo-6-fluoro-1,3-benzothiazol-2-yl)methylammonium Formula: C8H7BrFN2S+ MolecularWeight: 262.121983

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1SC(=N2)C[NH3+])Br)F

Isomeric SMILES

C1=C(C=C(C2=C1SC(=N2)C[NH3+])Br)F

InChI

InChI=1S/C8H6BrFN2S/c9-5-1-4(10)2-6-8(5)12-7(3-11)13-6/h1-2H,3,11H2/p+1