2-[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-[(2-fluorophenyl)thio]ethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(2-fluorophenyl)sulfanylethyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-[(2-fluorophenyl)thio]ethyl]piperazino]acetic acid Formula: C14H19FN2O2S MolecularWeight: 298.376263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=CC=C2F)CC(=O)O

Isomeric SMILES

C1CN(CCN1CCSC2=CC=CC=C2F)CC(=O)O

InChI

InChI=1S/C14H19FN2O2S/c15-12-3-1-2-4-13(12)20-10-9-16-5-7-17(8-6-16)11-14(18)19/h1-4H,5-11H2,(H,18,19)