4-[4-[1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]sulfonylphenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]sulfonylphenyl]benzenecarbonitrile Openeye Name: 4-[4-[[1-[2-(4-fluorophenyl)-2-oxo-ethyl]-4-piperidyl]sulfonyl]phenyl]benzonitrile CAS Name: 4-[4-[[1-[2-(4-fluorophenyl)-2-oxoethyl]-4-piperidinyl]sulfonyl]phenyl]benzonitrile IUPAC Name: 4-[4-[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]sulfonylphenyl]benzonitrile Traditional Name: 4-[4-[[1-[2-(4-fluorophenyl)-2-keto-ethyl]-4-piperidyl]sulfonyl]phenyl]benzonitrile Formula: C26H23FN2O3S MolecularWeight: 462.535823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N)CC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N)CC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H23FN2O3S/c27-23-9-5-22(6-10-23)26(30)18-29-15-13-25(14-16-29)33(31,32)24-11-7-21(8-12-24)20-3-1-19(17-28)2-4-20/h1-12,25H,13-16,18H2