1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-(4-fluorophenyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-(4-fluorophenyl)-4-[4-(2-pyrimidyl)piperazino]butane-1,4-dione Formula: C18H19FN4O2 MolecularWeight: 342.367463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN4O2/c19-15-4-2-14(3-5-15)16(24)6-7-17(25)22-10-12-23(13-11-22)18-20-8-1-9-21-18/h1-5,8-9H,6-7,10-13H2