3-fluoranyl-4-[methyl(thiolan-3-yl)amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[methyl(thiolan-3-yl)amino]benzenecarbonitrile Openeye Name: 3-fluoro-4-[methyl(tetrahydrothiophen-3-yl)amino]benzonitrile CAS Name: 3-fluoro-4-[methyl(3-thiolanyl)amino]benzonitrile IUPAC Name: 3-fluoro-4-[methyl(thiolan-3-yl)amino]benzonitrile Traditional Name: 3-fluoro-4-[methyl(tetrahydrothiophen-3-yl)amino]benzonitrile Formula: C12H13FN2S MolecularWeight: 236.308423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CN(C1CCSC1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C12H13FN2S/c1-15(10-4-5-16-8-10)12-3-2-9(7-14)6-11(12)13/h2-3,6,10H,4-5,8H2,1H3