2-[4-[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[4-(difluoromethylsulfanyl)benzoyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[4-(difluoromethylthio)phenyl]-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[4-(difluoromethylsulfanyl)benzoyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[4-(difluoromethylthio)benzoyl]piperazino]-1-pyrrolidino-ethanone Formula: C18H23F2N3O2S MolecularWeight: 383.455926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C18H23F2N3O2S/c19-18(20)26-15-5-3-14(4-6-15)17(25)23-11-9-21(10-12-23)13-16(24)22-7-1-2-8-22/h3-6,18H,1-2,7-13H2