5-[3-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperazin-1-yl]propoxy]-2,3-dihydro-1H-isoindole

Systemtic Name: 5-[3-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperazin-1-yl]propoxy]-2,3-dihydro-1H-isoindole Openeye Name: 5-[3-[4-(5-fluorobenzothiophen-3-yl)piperazin-1-yl]propoxy]isoindoline CAS Name: 5-[3-[4-(5-fluoro-1-benzothiophen-3-yl)-1-piperazinyl]propoxy]-2,3-dihydro-1H-isoindole IUPAC Name: 5-[3-[4-(5-fluoro-1-benzothiophen-3-yl)piperazin-1-yl]propoxy]-2,3-dihydro-1H-isoindole Traditional Name: 5-[3-[4-(5-fluorobenzothiophen-3-yl)piperazino]propoxy]isoindoline Formula: C23H26FN3OS MolecularWeight: 411.535443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=C(CNC3)C=C2)C4=CSC5=C4C=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=C(CNC3)C=C2)C4=CSC5=C4C=C(C=C5)F

InChI

InChI=1S/C23H26FN3OS/c24-19-3-5-23-21(13-19)22(16-29-23)27-9-7-26(8-10-27)6-1-11-28-20-4-2-17-14-25-15-18(17)12-20/h2-5,12-13,16,25H,1,6-11,14-15H2