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

Systemtic Name: 3-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(1-ethyl-5-tetrazolyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(1-ethyltetrazol-5-yl)thio]methyl]-4-fluoro-benzonitrile Formula: C11H10FN5S MolecularWeight: 263.294003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CCN1C(=NN=N1)SCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C11H10FN5S/c1-2-17-11(14-15-16-17)18-7-9-5-8(6-13)3-4-10(9)12/h3-5H,2,7H2,1H3