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

Systemtic Name: 3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(1-cyclohexyltetrazol-5-yl)thio]methyl]-4-fluoro-benzonitrile Formula: C15H16FN5S MolecularWeight: 317.384443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC3=C(C=CC(=C3)C#N)F

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC3=C(C=CC(=C3)C#N)F

InChI

InChI=1S/C15H16FN5S/c16-14-7-6-11(9-17)8-12(14)10-22-15-18-19-20-21(15)13-4-2-1-3-5-13/h6-8,13H,1-5,10H2