[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-(2-methylphenyl)methanone

Systemtic Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-(2-methylphenyl)methanone Openeye Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-(o-tolyl)methanone CAS Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]-(2-methylphenyl)methanone IUPAC Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-(2-methylphenyl)methanone Traditional Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-(o-tolyl)methanone Formula: C25H27FN4O MolecularWeight: 418.506483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC=C3C)C4=CC(=CC=C4)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC=C3C)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C25H27FN4O/c1-4-21-18(3)27-23(19-9-7-10-20(26)16-19)28-24(21)29-12-14-30(15-13-29)25(31)22-11-6-5-8-17(22)2/h5-11,16H,4,12-15H2,1-3H3