1-[4-[5-[(2-fluorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-[5-[(2-fluorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]butan-1-one Openeye Name: 1-[4-[5-[(2-fluorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[5-[(2-fluorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-[5-[(2-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]piperazin-1-yl]butan-1-one Traditional Name: 1-[4-[5-(2-fluorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]piperazino]butan-1-one Formula: C21H27FN4O MolecularWeight: 370.463683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3F)C)C

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3F)C)C

InChI

InChI=1S/C21H27FN4O/c1-4-7-20(27)25-10-12-26(13-11-25)21-18(15(2)23-16(3)24-21)14-17-8-5-6-9-19(17)22/h5-6,8-9H,4,7,10-14H2,1-3H3