1'-[5-(2-phenylpyrimidin-4-yl)-1H-pyrazol-3-yl]spiro[2-benzofuran-3,4'-piperidine]-1-one

Systemtic Name: 1'-[5-(2-phenylpyrimidin-4-yl)-1H-pyrazol-3-yl]spiro[2-benzofuran-3,4'-piperidine]-1-one Openeye Name: 1'-[5-(2-phenylpyrimidin-4-yl)-1H-pyrazol-3-yl]spiro[isobenzofuran-3,4'-piperidine]-1-one CAS Name: 1'-[5-(2-phenyl-4-pyrimidinyl)-1H-pyrazol-3-yl]-1-spiro[isobenzofuran-3,4'-piperidine]one IUPAC Name: 1'-[5-(2-phenylpyrimidin-4-yl)-1H-pyrazol-3-yl]spiro[2-benzofuran-3,4'-piperidine]-1-one Traditional Name: 1'-[5-(2-phenylpyrimidin-4-yl)-1H-pyrazol-3-yl]spiro[phthalan-3,4'-piperidine]-1-one Formula: C25H21N5O2 MolecularWeight: 423.46654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C3=CC=CC=C3C(=O)O2)C4=NNC(=C4)C5=NC(=NC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC12C3=CC=CC=C3C(=O)O2)C4=NNC(=C4)C5=NC(=NC=C5)C6=CC=CC=C6

InChI

InChI=1S/C25H21N5O2/c31-24-18-8-4-5-9-19(18)25(32-24)11-14-30(15-12-25)22-16-21(28-29-22)20-10-13-26-23(27-20)17-6-2-1-3-7-17/h1-10,13,16H,11-12,14-15H2,(H,28,29)