5-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperazin-1-yl]butoxy]-2,3-dihydroisoindol-1-one

Systemtic Name: 5-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperazin-1-yl]butoxy]-2,3-dihydroisoindol-1-one Openeye Name: 5-[4-[4-(5-fluorobenzothiophen-3-yl)piperazin-1-yl]butoxy]isoindolin-1-one CAS Name: 5-[4-[4-(5-fluoro-1-benzothiophen-3-yl)-1-piperazinyl]butoxy]-2,3-dihydroisoindol-1-one IUPAC Name: 5-[4-[4-(5-fluoro-1-benzothiophen-3-yl)piperazin-1-yl]butoxy]-2,3-dihydroisoindol-1-one Traditional Name: 5-[4-[4-(5-fluorobenzothiophen-3-yl)piperazino]butoxy]isoindolin-1-one Formula: C24H26FN3O2S MolecularWeight: 439.545543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C(=O)NC3)C4=CSC5=C4C=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C(=O)NC3)C4=CSC5=C4C=C(C=C5)F

InChI

InChI=1S/C24H26FN3O2S/c25-18-3-6-23-21(14-18)22(16-31-23)28-10-8-27(9-11-28)7-1-2-12-30-19-4-5-20-17(13-19)15-26-24(20)29/h3-6,13-14,16H,1-2,7-12,15H2,(H,26,29)