2-[(4-bromophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-bromophenyl)methylthio]-1-[4-(2-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromobenzyl)thio]-1-[4-(2-fluorophenyl)piperazino]ethanone Formula: C19H20BrFN2OS MolecularWeight: 423.342303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)CSCC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)CSCC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrFN2OS/c20-16-7-5-15(6-8-16)13-25-14-19(24)23-11-9-22(10-12-23)18-4-2-1-3-17(18)21/h1-8H,9-14H2