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

Systemtic Name: cyclohexyl-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: cyclohexyl-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: cyclohexyl-[4-[2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[4-[2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: cyclohexyl-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]methanone Formula: C22H27FN4O MolecularWeight: 382.474383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4CCCCC4

InChI

InChI=1S/C22H27FN4O/c1-16-14-20(25-21(24-16)18-8-5-9-19(23)15-18)26-10-12-27(13-11-26)22(28)17-6-3-2-4-7-17/h5,8-9,14-15,17H,2-4,6-7,10-13H2,1H3