[3-(phenoxymethyl)-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(phenoxymethyl)-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-(phenoxymethyl)benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-(phenoxymethyl)-2-benzofuranyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-(phenoxymethyl)-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-(phenoxymethyl)benzofuran-2-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

InChI

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