2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylmethyl]benzenecarbonitrile Openeye Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylmethyl]benzonitrile CAS Name: 2-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]sulfonylmethyl]benzonitrile IUPAC Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylmethyl]benzonitrile Traditional Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazino]sulfonylmethyl]benzonitrile Formula: C25H23F2N3O2S MolecularWeight: 467.530826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)CC4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)CC4=CC=CC=C4C#N

InChI

InChI=1S/C25H23F2N3O2S/c26-23-9-5-19(6-10-23)25(20-7-11-24(27)12-8-20)29-13-15-30(16-14-29)33(31,32)18-22-4-2-1-3-21(22)17-28/h1-12,25H,13-16,18H2