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2-pentyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-phthalazin-1-one
2-pentyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-phthalazin-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
Isomeric SMILES
CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
InChI
InChI=1S/C25H27F3N4O2/c1-2-3-6-12-32-23(33)21-11-5-4-10-20(21)22(29-32)24(34)31-15-13-30(14-16-31)19-9-7-8-18(17-19)25(26,27)28/h4-5,7-11,17H,2-3,6,12-16H2,1H3
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