3-[(Z)-2-cyano-2-methylsulfonyl-ethenyl]-6-(dimethylamino)-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(Z)-2-cyano-2-methylsulfonyl-ethenyl]-6-(dimethylamino)-2-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(Z)-2-cyano-2-methylsulfonyl-vinyl]-6-(dimethylamino)-2-fluoro-benzonitrile CAS Name: 3-[(Z)-2-cyano-2-methylsulfonylethenyl]-6-(dimethylamino)-2-fluorobenzonitrile IUPAC Name: 3-[(Z)-2-cyano-2-methylsulfonylethenyl]-6-(dimethylamino)-2-fluorobenzonitrile Traditional Name: 3-[(Z)-2-cyano-2-mesyl-vinyl]-6-(dimethylamino)-2-fluoro-benzonitrile Formula: C13H12FN3O2S MolecularWeight: 293.316683

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=C(C=C1)C=C(C#N)S(=O)(=O)C)F)C#N

Isomeric SMILES

CN(C)C1=C(C(=C(C=C1)/C=C(/C#N)\S(=O)(=O)C)F)C#N

InChI

InChI=1S/C13H12FN3O2S/c1-17(2)12-5-4-9(13(14)11(12)8-16)6-10(7-15)20(3,18)19/h4-6H,1-3H3/b10-6-