6,6-bis(4-fluorophenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 6,6-bis(4-fluorophenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]hexan-1-one Openeye Name: 6,6-bis(4-fluorophenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]hexan-1-one CAS Name: 6,6-bis(4-fluorophenyl)-1-[4-[2-(phenylthio)ethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 6,6-bis(4-fluorophenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]hexan-1-one Traditional Name: 6,6-bis(4-fluorophenyl)-1-[4-[2-(phenylthio)ethyl]piperazino]hexan-1-one Formula: C30H34F2N2OS MolecularWeight: 508.665566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C30H34F2N2OS/c31-26-14-10-24(11-15-26)29(25-12-16-27(32)17-13-25)8-4-5-9-30(35)34-20-18-33(19-21-34)22-23-36-28-6-2-1-3-7-28/h1-3,6-7,10-17,29H,4-5,8-9,18-23H2