3-[5-(5-bromanylpyridin-2-yl)-1,2,3,4-tetrazol-2-yl]-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[5-(5-bromanylpyridin-2-yl)-1,2,3,4-tetrazol-2-yl]-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[5-(5-bromo-2-pyridyl)tetrazol-2-yl]-5-fluoro-benzonitrile CAS Name: 3-[5-(5-bromo-2-pyridinyl)-2-tetrazolyl]-5-fluorobenzonitrile IUPAC Name: 3-[5-(5-bromopyridin-2-yl)tetrazol-2-yl]-5-fluorobenzonitrile Traditional Name: 3-[5-(5-bromo-2-pyridyl)tetrazol-2-yl]-5-fluoro-benzonitrile Formula: C13H6BrFN6 MolecularWeight: 345.129343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1Br)C2=NN(N=N2)C3=CC(=CC(=C3)C#N)F

Isomeric SMILES

C1=CC(=NC=C1Br)C2=NN(N=N2)C3=CC(=CC(=C3)C#N)F

InChI

InChI=1S/C13H6BrFN6/c14-9-1-2-12(17-7-9)13-18-20-21(19-13)11-4-8(6-16)3-10(15)5-11/h1-5,7H