1-[4-[2-(4-fluorophenyl)cyclopropyl]carbonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-[2-(4-fluorophenyl)cyclopropyl]carbonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[2-(4-fluorophenyl)cyclopropyl]-oxomethyl]-1-piperazinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazino]ethanone Formula: C23H25FN2O2S MolecularWeight: 412.520203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSCC2=CC=CC=C2)C(=O)C3CC3C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CSCC2=CC=CC=C2)C(=O)C3CC3C4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN2O2S/c24-19-8-6-18(7-9-19)20-14-21(20)23(28)26-12-10-25(11-13-26)22(27)16-29-15-17-4-2-1-3-5-17/h1-9,20-21H,10-16H2