1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-phenethylsulfanyl-propan-2-ol

Systemtic Name: 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-phenethylsulfanyl-propan-2-ol Openeye Name: 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-phenethylsulfanyl-propan-2-ol CAS Name: 1-[4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl]-3-(phenethylthio)-2-propanol IUPAC Name: 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-phenethylsulfanylpropan-2-ol Traditional Name: 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazino]-3-(phenethylthio)propan-2-ol Formula: C31H38F2N2OS MolecularWeight: 524.708026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC(CSCCC4=CC=CC=C4)O

Isomeric SMILES

C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC(CSCCC4=CC=CC=C4)O

InChI

InChI=1S/C31H38F2N2OS/c32-28-12-8-26(9-13-28)31(27-10-14-29(33)15-11-27)7-4-17-34-18-20-35(21-19-34)23-30(36)24-37-22-16-25-5-2-1-3-6-25/h1-3,5-6,8-15,30-31,36H,4,7,16-24H2