2-fluoranyl-6-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanyl-benzonitrile CAS Name: 2-fluoro-6-[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]benzonitrile IUPAC Name: 2-fluoro-6-[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanylbenzonitrile Traditional Name: 2-fluoro-6-[(1-p-cumenyltetrazol-5-yl)thio]benzonitrile Formula: C17H14FN5S MolecularWeight: 339.389963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SC3=CC=CC(=C3C#N)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SC3=CC=CC(=C3C#N)F

InChI

InChI=1S/C17H14FN5S/c1-11(2)12-6-8-13(9-7-12)23-17(20-21-22-23)24-16-5-3-4-15(18)14(16)10-19/h3-9,11H,1-2H3