2-fluoranyl-5-[[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-(2-oxidanylidenepiperidin-3-yl)amino]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-5-[[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-(2-oxidanylidenepiperidin-3-yl)amino]benzenecarbonitrile Openeye Name: 2-fluoro-5-[2-fluoro-4-(2-methylsulfonylphenyl)-N-(2-oxo-3-piperidyl)anilino]benzonitrile CAS Name: 2-fluoro-5-[2-fluoro-4-(2-methylsulfonylphenyl)-N-(2-oxo-3-piperidinyl)anilino]benzonitrile IUPAC Name: 2-fluoro-5-[2-fluoro-4-(2-methylsulfonylphenyl)-N-(2-oxopiperidin-3-yl)anilino]benzonitrile Traditional Name: 2-fluoro-5-[2-fluoro-N-(2-keto-3-piperidyl)-4-(2-mesylphenyl)anilino]benzonitrile Formula: C25H21F2N3O3S MolecularWeight: 481.514346

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N(C3CCCNC3=O)C4=CC(=C(C=C4)F)C#N)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N(C3CCCNC3=O)C4=CC(=C(C=C4)F)C#N)F

InChI

InChI=1S/C25H21F2N3O3S/c1-34(32,33)24-7-3-2-5-19(24)16-8-11-22(21(27)14-16)30(23-6-4-12-29-25(23)31)18-9-10-20(26)17(13-18)15-28/h2-3,5,7-11,13-14,23H,4,6,12H2,1H3,(H,29,31)