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6-propyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one
6-propyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCC1=CC(=O)N=C(N1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
CCCC1=CC(=O)N=C(N1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C18H21F3N4O/c1-2-4-14-12-16(26)23-17(22-14)25-9-7-24(8-10-25)15-6-3-5-13(11-15)18(19,20)21/h3,5-6,11-12H,2,4,7-10H2,1H3,(H,22,23,26)
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- 5-[(4-tert-butylphenyl)methyl]-6-methyl-2-[4-(phenylmethyl)piperazin-1-yl]-1H-pyrimidin-4-one
