2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazino]-N-[2-(phenylthio)phenyl]acetamide Formula: C31H29F2N3OS MolecularWeight: 529.643266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C31H29F2N3OS/c32-25-14-10-23(11-15-25)31(24-12-16-26(33)17-13-24)36-20-18-35(19-21-36)22-30(37)34-28-8-4-5-9-29(28)38-27-6-2-1-3-7-27/h1-17,31H,18-22H2,(H,34,37)