4-[[1-(2-bromanyl-4-fluoranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfonyl]butanenitrile

Systemtic Name: 4-[[1-(2-bromanyl-4-fluoranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfonyl]butanenitrile Openeye Name: 4-[1-(2-bromo-4-fluoro-phenyl)tetrazol-5-yl]sulfonylbutanenitrile CAS Name: 4-[[1-(2-bromo-4-fluorophenyl)-5-tetrazolyl]sulfonyl]butanenitrile IUPAC Name: 4-[1-(2-bromo-4-fluorophenyl)tetrazol-5-yl]sulfonylbutanenitrile Traditional Name: 4-[1-(2-bromo-4-fluoro-phenyl)tetrazol-5-yl]sulfonylbutyronitrile Formula: C11H9BrFN5O2S MolecularWeight: 374.188863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Br)N2C(=NN=N2)S(=O)(=O)CCCC#N

Isomeric SMILES

C1=CC(=C(C=C1F)Br)N2C(=NN=N2)S(=O)(=O)CCCC#N

InChI

InChI=1S/C11H9BrFN5O2S/c12-9-7-8(13)3-4-10(9)18-11(15-16-17-18)21(19,20)6-2-1-5-14/h3-4,7H,1-2,6H2