4-fluoranyl-N-[2-[4-[2-(phenylmethylsulfanyl)ethanoyl]piperazin-1-yl]ethyl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-[4-[2-(phenylmethylsulfanyl)ethanoyl]piperazin-1-yl]ethyl]benzamide Openeye Name: N-[2-[4-(2-benzylsulfanylacetyl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: 4-fluoro-N-[2-[4-[1-oxo-2-(phenylmethylthio)ethyl]-1-piperazinyl]ethyl]benzamide IUPAC Name: N-[2-[4-(2-benzylsulfanylacetyl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: N-[2-[4-[2-(benzylthio)acetyl]piperazino]ethyl]-4-fluoro-benzamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)F)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)F)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C22H26FN3O2S/c23-20-8-6-19(7-9-20)22(28)24-10-11-25-12-14-26(15-13-25)21(27)17-29-16-18-4-2-1-3-5-18/h1-9H,10-17H2,(H,24,28)