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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC=CC=C3)CC4=CC(=CC=C4)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC=CC=C3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C25H27FN4O/c1-3-23-22(17-19-8-7-11-21(26)16-19)24(28-18(2)27-23)29-12-14-30(15-13-29)25(31)20-9-5-4-6-10-20/h4-11,16H,3,12-15,17H2,1-2H3