2-[2-[4-(6-fluoranyl-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]-3-oxidanyl-3H-isoindol-1-one

Systemtic Name: 2-[2-[4-(6-fluoranyl-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]-3-oxidanyl-3H-isoindol-1-one Openeye Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)-1-piperidyl]ethyl]-3-hydroxy-isoindolin-1-one CAS Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)-1-piperidinyl]ethyl]-3-hydroxy-3H-isoindol-1-one IUPAC Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]-3-hydroxy-3H-isoindol-1-one Traditional Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)piperidino]ethyl]-3-hydroxy-isoindolin-1-one Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NSC3=C2C=CC(=C3)F)CCN4C(C5=CC=CC=C5C4=O)O

Isomeric SMILES

C1CN(CCC1C2=NSC3=C2C=CC(=C3)F)CCN4C(C5=CC=CC=C5C4=O)O

InChI

InChI=1S/C22H22FN3O2S/c23-15-5-6-18-19(13-15)29-24-20(18)14-7-9-25(10-8-14)11-12-26-21(27)16-3-1-2-4-17(16)22(26)28/h1-6,13-14,21,27H,7-12H2