3-[2-oxidanylidene-2-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-oxidanylidene-2-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-oxo-2-[3-[5-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-oxo-2-[3-(5-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]ethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-oxo-2-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]ethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-keto-2-[3-[5-(4-pyridyl)pyrimidin-4-yl]piperidino]ethyl]phthalide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2C3=CC=CC=C3C(=O)O2)C4=NC=NC=C4C5=CC=NC=C5

Isomeric SMILES

C1CC(CN(C1)C(=O)CC2C3=CC=CC=C3C(=O)O2)C4=NC=NC=C4C5=CC=NC=C5

InChI

InChI=1S/C24H22N4O3/c29-22(12-21-18-5-1-2-6-19(18)24(30)31-21)28-11-3-4-17(14-28)23-20(13-26-15-27-23)16-7-9-25-10-8-16/h1-2,5-10,13,15,17,21H,3-4,11-12,14H2