2-[2-[4-(6-fluoranyl-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(6-fluoranyl-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)-1-piperidyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)-1-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[4-(6-fluoro-1,2-benzothiazol-3-yl)piperidino]ethyl]isoindoline-1,3-quinone Formula: C22H20FN3O2S MolecularWeight: 409.476503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20FN3O2S/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/h1-6,13-14H,7-12H2