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

Systemtic Name: 4-[[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[2-[(2-fluorophenyl)thio]ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-[(2-fluorophenyl)thio]ethyl]piperazino]methyl]benzonitrile Formula: C20H22FN3S MolecularWeight: 355.472183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=CC=C2F)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1CCSC2=CC=CC=C2F)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H22FN3S/c21-19-3-1-2-4-20(19)25-14-13-23-9-11-24(12-10-23)16-18-7-5-17(15-22)6-8-18/h1-8H,9-14,16H2