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2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-6-propyl-1H-pyrimidin-4-one
2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-6-propyl-1H-pyrimidin-4-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCC1=CC(=O)N=C(N1)NC2=CC(=C(C=C2)Cl)C(F)(F)F
Isomeric SMILES
CCCC1=CC(=O)N=C(N1)NC2=CC(=C(C=C2)Cl)C(F)(F)F
InChI
InChI=1S/C14H13ClF3N3O/c1-2-3-8-7-12(22)21-13(19-8)20-9-4-5-11(15)10(6-9)14(16,17)18/h4-7H,2-3H2,1H3,(H2,19,20,21,22)
Other Product
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- 3-(3-hydroxyphenyl)propanoic acid
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