2-[[4-(4-fluorophenyl)piperazin-1-yl]sulfonylmethyl]-3-phenyl-propane-1-thiol

Systemtic Name: 2-[[4-(4-fluorophenyl)piperazin-1-yl]sulfonylmethyl]-3-phenyl-propane-1-thiol Openeye Name: 2-benzyl-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-propane-1-thiol CAS Name: 2-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonylmethyl]-3-phenyl-1-propanethiol IUPAC Name: 2-benzyl-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropane-1-thiol Traditional Name: 2-benzyl-3-[4-(4-fluorophenyl)piperazino]sulfonyl-propane-1-thiol Formula: C20H25FN2O2S2 MolecularWeight: 408.553103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CC(CC3=CC=CC=C3)CS

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CC(CC3=CC=CC=C3)CS

InChI

InChI=1S/C20H25FN2O2S2/c21-19-6-8-20(9-7-19)22-10-12-23(13-11-22)27(24,25)16-18(15-26)14-17-4-2-1-3-5-17/h1-9,18,26H,10-16H2