1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propane-2-thiol

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propane-2-thiol Openeye Name: 1-(2-allylphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propane-2-thiol CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-3-(2-prop-2-enylphenoxy)-2-propanethiol IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propane-2-thiol Traditional Name: 1-(2-allylphenoxy)-3-[4-(4-fluorophenyl)piperazino]propane-2-thiol Formula: C22H27FN2OS MolecularWeight: 386.525983

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)S

Isomeric SMILES

C=CCC1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)S

InChI

InChI=1S/C22H27FN2OS/c1-2-5-18-6-3-4-7-22(18)26-17-21(27)16-24-12-14-25(15-13-24)20-10-8-19(23)9-11-20/h2-4,6-11,21,27H,1,5,12-17H2