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

Systemtic Name: 3-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(1-cyclopropyl-5-tetrazolyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(1-cyclopropyltetrazol-5-yl)thio]methyl]-4-fluoro-benzonitrile Formula: C12H10FN5S MolecularWeight: 275.304703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCC3=C(C=CC(=C3)C#N)F

Isomeric SMILES

C1CC1N2C(=NN=N2)SCC3=C(C=CC(=C3)C#N)F

InChI

InChI=1S/C12H10FN5S/c13-11-4-1-8(6-14)5-9(11)7-19-12-15-16-17-18(12)10-2-3-10/h1,4-5,10H,2-3,7H2