Emitefur
HIT212712575
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HIT ID: HIT212712575
Cas No: 110690-43-2
分子式: C28H19FN4O8
分子量: 558.478
常用名: Emitefur
氢键受体数 (HBA): 8
氢键供体数 (HBD): 0
LogP: 4.980754
IUPAC: 6-(benzoyloxy)-3-cyanopyridin-2-yl 3-[3-(ethoxymethyl)-5-fluoro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-1-carbonyl]benzoate
IUPAC: 6-(benzoyloxy)-3-cyanopyridin-2-yl 3-[3-(ethoxymethyl)-5-fluoro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-1-carbonyl]benzoate
SMILES: CCOCn1cc(F)c(=O)n(C(=O)c2cccc(c2)C(=O)Oc2nc(OC(=O)c3ccccc3)ccc2C#N)c1=O
SMILES: CCOCn1cc(F)c(=O)n(C(=O)c2cccc(c2)C(=O)Oc2nc(OC(=O)c3ccccc3)ccc2C#N)c1=O
InChI key: WTSKMKRYHATLLL-UHFFFAOYSA-N
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